Casanovo
algorithm · Transformer (AR)
First Transformer
| Kind | algorithm |
| Deep learning | yes |
| Acquisition | DDA |
| Family | Transformer (AR) |
Code
Live stars, open issues and last-push figures are on the Code activity chart.
Checkpoints
| Version | Trained on | Host | Licence | Size | Checked |
|---|---|---|---|---|---|
| nine-species | — | Zenodo archival | CC-BY-4.0 | 5.1 GB | live 2026-10-02 |
| data set and weights | — | Zenodo archival | Apache-2.0 | 3.9 GB | live 2026-10-02 |
| MassIVE-KB splits | — | institutional | not stated | — | live 2026-10-02 |
| v4.0.0 | MassIVE-KB v1 | GitHub release | Apache-2.0 | — | live 2026-10-02 |
| v4.2.0 | ~2M PSMs from MassIVE-KB v1 + v2.0.15 | GitHub release | Apache-2.0 | — | live 2026-10-02 |
| v5.0.0 | — | GitHub release | Apache-2.0 | — | live 2026-10-02 |
| v5.2.0 | the default –model orbitrap selector from v5.2.0 onward | GitHub release | Apache-2.0 | — | live 2026-10-02 |
| v5.2.0 | the –model timstof selector from v5.2.0 onward | GitHub release | Apache-2.0 | 575 MB | live 2026-10-06 |
A host marked archival has a DOI and keeps what it is given. The others can move or disappear, which is why they are checked rather than merely listed. verified means the bytes were fetched and hashed on the date shown; live means only that the host answered when last asked.
Data
What the papers describing this method trained it on and reported its results on, as each paper states it. A version is named only where the paper names one.
Trained on
- A deep proteome and transcriptome abundance atlas of 29 healthy human tissues (MSV000083508) (as deposited) · 2024 peer-reviewed
- Casanovo digestion enzyme bias data (as deposited) · 2024 peer-reviewed, 2025 preprint
- Casanovo non-enzymatic fine-tuning set (as deposited) · 2024 peer-reviewed
- Confetti: A Multi-protease Map of the HeLa Proteome for Comprehensive Proteomics (MSV000081607) (as deposited) · 2024 peer-reviewed
- HeLa proteome of 12,250 protein-coding genes (MSV000081563) (as deposited) · 2024 peer-reviewed
- Human Testis LC-MS/MS (as deposited) · 2024 peer-reviewed
- Human testis off-line LC-MS/MS (as deposited) · 2024 peer-reviewed
- MassIVE-KB (v1) · 2025 preprint
- MassIVE-KB (v1 30M-PSM split (Casanovo)) · 2023 preprint, 2024 peer-reviewed, 2024 peer-reviewed
- MassIVE-KB (v2) · 2025 preprint
- Nine-species benchmark (original (DeepNovo, 2017)) · 2022 ML conference, 2023 preprint, 2024 peer-reviewed
Evaluated on
- A deep proteome and transcriptome abundance atlas of 29 healthy human tissues (MSV000083508) (as deposited) · 2024 peer-reviewed
- Bering Strait surface water and Chukchi Sea bottom water microbiome metaproteomics (as deposited) · 2023 preprint, 2024 peer-reviewed
- Casanovo digestion enzyme bias data (as deposited) · 2024 peer-reviewed, 2025 preprint
- Casanovo non-enzymatic fine-tuning set (as deposited) · 2024 peer-reviewed
- Confetti: A Multi-protease Map of the HeLa Proteome for Comprehensive Proteomics (MSV000081607) (as deposited) · 2024 peer-reviewed
- HeLa proteome of 12,250 protein-coding genes (MSV000081563) (as deposited) · 2024 peer-reviewed
- Human Testis LC-MS/MS (as deposited) · 2024 peer-reviewed
- Human testis off-line LC-MS/MS (as deposited) · 2024 peer-reviewed
- MassIVE-KB (v1) · 2025 preprint
- MassIVE-KB (v1 30M-PSM split (Casanovo)) · 2024 peer-reviewed
- MassIVE-KB (v2) · 2025 preprint
- Nine-species benchmark (version not stated) · 2022 ML conference
- Nine-species benchmark (original (DeepNovo, 2017)) · 2023 preprint, 2024 peer-reviewed
- Nine-species benchmark (revised (build not stated)) · 2023 preprint, 2024 peer-reviewed
- PXD066485 (as deposited) · 2025 preprint
Deposited
- Casanovo de novo peptide sequencing immunopeptidomics, metaproteomics and dark proteome (as deposited) · 2024 peer-reviewed
- Casanovo digestion enzyme bias data (as deposited) · 2024 peer-reviewed
- Casanovo non-enzymatic fine-tuning set (as deposited) · 2024 peer-reviewed
- De novo nine-species benchmark peptide identifications for Casanovo and other methods (as deposited) · 2024 peer-reviewed
Benchmarks
- denovo_benchmarks: median peptide-level average precision 0.777 over 86 datasets, median rank 7 of 15 (version 5.0.0).
- ProteoBench, on the nine-species benchmark, ProteoBench selection: peptide-level AUC 0.901; precision 0.650 at 100% coverage; amino-acid AUC 0.951 (version 4.0, beam search, submitted 2026-08-07).
Both are mass-based matches on the tool’s most recent run. What these numbers mean.
Reported comparison
The comparison table this method’s own papers print, standardised: every value on a 0-1 scale, methods down the side, the measure and then the species across. These are numbers papers report about themselves and their baselines. They are not a leaderboard, and they do not compare across tables: each was produced by a different group, on the dataset named in its corner, with each baseline either retrained, run from released weights or quoted from another paper. Where the paper says which, it follows the method’s name (hover it for the sentence); most papers do not say. Bold is the best value in a column and underline the runner-up, our ranking rather than the paper’s own marks.
Table2
De novo mass spectrometry peptide sequencing with a transformer model, page 6: Empirical comparison of Casanovo, DeepNovo and PointNovo. The table lists the peptide-level and amino acid-level precision of three competing models and coverage of Casanovo with precursor m/z filtering on all nine benchmark cross-validation folds. Each fold’s test set contains spectra from a single species, with nearly disjoint sets of peptides between species. For cross-validation folds corresponding to mouse and human, five models were trained with different random initializations. For these species, we report standard deviation of the performance measures.
| Nine-species benchmark | Peptide precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | |
| DeepNovo · released | 0.286 | 0.293 | 0.462 | 0.422 | 0.330 | 0.454 | 0.436 | 0.449 | 0.253 |
| PointNovo · quoted | 0.355 | 0.351 | 0.534 | 0.478 | 0.396 | 0.513 | 0.511 | 0.518 | 0.298 |
| Casanovo | 0.665 | 0.683 | 0.824 | 0.771 | 0.732 | 0.771 | 0.798 | 0.805 | 0.695 |
| Nine-species benchmark | Peptide coverage | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | |
| Casanovo | 0.666 | 0.537 | 0.681 | 0.630 | 0.557 | 0.557 | 0.547 | 0.671 | 0.534 |
| Nine-species benchmark | Peptide precision at coverage 1 | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | |
| Casanovo | 0.443 | 0.367 | 0.561 | 0.486 | 0.408 | 0.460 | 0.437 | 0.540 | 0.371 |
| Nine-species benchmark | Amino acid precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | |
| DeepNovo · released | 0.623 | 0.610 | 0.750 | 0.694 | 0.630 | 0.731 | 0.679 | 0.742 | 0.602 |
| PointNovo · quoted | 0.626 | 0.606 | 0.779 | 0.712 | 0.644 | 0.733 | 0.730 | 0.768 | 0.589 |
| Casanovo | 0.899 | 0.898 | 0.952 | 0.935 | 0.920 | 0.929 | 0.920 | 0.943 | 0.908 |
| Nine-species benchmark | Amino acid precision at coverage 1 | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | |
| Casanovo | 0.562 | 0.424 | 0.591 | 0.518 | 0.461 | 0.471 | 0.442 | 0.573 | 0.405 |
Compared against in other papers (24)
95 tables from 24 papers that report this method as a baseline, newest first. The caveats of the comparisons above hold twice over: each paper ran, retrained or quoted this method its own way, so its number here is that paper’s claim, not a measurement of the method. Where a paper says which it did, the word follows the method’s name.
ScopeNovo: a De Novo Peptide Sequencing Method Using Spectrum-Spectrum Similarity to Refine the Prediction Accuracy (2026) · 2 tables
Table 1 (Nine-species · revised (build not stated))
ScopeNovo: a De Novo Peptide Sequencing Method Using Spectrum-Spectrum Similarity to Refine the Prediction Accuracy, page 5: Comparison of de novo peptide sequencing methods on 9-species-V1 and 9-species-V2 benchmarks. For ScopeNovo we report two operating regimes: Setting 1 (External Library, spectrum-consistency reranking against a curated external spectral library), which characterizes the upper-bound performance attainable when high-quality external spectral resources are available; and Setting 2 (Self-Constructed Library), in which the reference library is bootstrapped entirely from high-confidence in-batch de novo predictions on the test data itself, placing ScopeNovo under the same resource assumptions as the baselines and yielding a direct comparison. In each column, the best value among the baselines and ScopeNovo (Setting 2) is in bold; ScopeNovo (Setting 1) is reported separately for reference and excluded from the bold comparison.
|
Nine-species benchmark revised (build not stated) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| Casanovo | 0.923 | 0.787 | 0.776 | 0.856 | 0.828 | 0.806 | 0.854 | 0.874 | 0.865 | 0.881 |
| Casanovo V2 | 0.843 | 0.799 | 0.788 | 0.865 | 0.836 | 0.813 | 0.867 | 0.882 | 0.875 | 0.865 |
| InstaNovo | 0.852 | 0.751 | 0.799 | 0.847 | 0.848 | 0.634 | 0.894 | 0.864 | 0.877 | 0.850 |
| ContraNovo | 0.863 | 0.802 | 0.817 | 0.909 | 0.864 | 0.830 | 0.903 | 0.881 | 0.883 | 0.865 |
| AdaNovo | 0.792 | 0.816 | 0.756 | 0.800 | 0.804 | 0.757 | 0.759 | 0.831 | 0.801 | 0.794 |
| RankNovo | 0.836 | 0.836 | 0.891 | 0.836 | 0.879 | 0.920 | 0.896 | 0.893 | 0.879 | 0.880 |
| π-PrimeNovo | 0.874 | 0.806 | 0.824 | 0.870 | 0.869 | 0.808 | 0.921 | 0.885 | 0.891 | 0.866 |
| ScopeNovo Setting 1 | 0.885 | 0.822 | 0.839 | 0.884 | 0.882 | 0.841 | 0.931 | 0.897 | 0.900 | 0.885 |
| ScopeNovo Setting 2 | 0.877 | 0.814 | 0.829 | 0.879 | 0.874 | 0.821 | 0.926 | 0.889 | 0.892 | 0.868 |
|
Nine-species benchmark revised (build not stated) |
Peptide accuracy | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| Casanovo | 0.687 | 0.522 | 0.579 | 0.662 | 0.656 | 0.522 | 0.645 | 0.730 | 0.738 | 0.682 |
| Casanovo V2 | 0.693 | 0.532 | 0.587 | 0.670 | 0.661 | 0.531 | 0.654 | 0.737 | 0.743 | 0.683 |
| InstaNovo | 0.704 | 0.512 | 0.625 | 0.670 | 0.666 | 0.504 | 0.679 | 0.721 | 0.758 | 0.698 |
| ContraNovo | 0.709 | 0.533 | 0.615 | 0.759 | 0.698 | 0.567 | 0.722 | 0.729 | 0.725 | 0.701 |
| AdaNovo | 0.636 | 0.624 | 0.597 | 0.590 | 0.641 | 0.472 | 0.538 | 0.693 | 0.653 | 0.635 |
| RankNovo | 0.713 | 0.603 | 0.617 | 0.717 | 0.712 | 0.559 | 0.744 | 0.724 | 0.680 | 0.682 |
| π-PrimeNovo | 0.712 | 0.572 | 0.612 | 0.710 | 0.714 | 0.548 | 0.766 | 0.719 | 0.684 | 0.697 |
| ScopeNovo Setting 1 | 0.748 | 0.664 | 0.669 | 0.762 | 0.772 | 0.664 | 0.816 | 0.771 | 0.702 | 0.737 |
| ScopeNovo Setting 2 | 0.728 | 0.619 | 0.641 | 0.750 | 0.743 | 0.611 | 0.788 | 0.745 | 0.691 | 0.716 |
The paper bolds the best of the baselines and ScopeNovo (Setting 2) only: 'ScopeNovo (Setting 1) is reported separately for reference and excluded from the bold comparison.' Bold and underline here rank every row, Setting 1 included; the paper's own marks were checked against its rule, and match it.
Table 1 (Nine-species · original (DeepNovo, 2017))
ScopeNovo: a De Novo Peptide Sequencing Method Using Spectrum-Spectrum Similarity to Refine the Prediction Accuracy, page 5: Comparison of de novo peptide sequencing methods on 9-species-V1 and 9-species-V2 benchmarks. For ScopeNovo we report two operating regimes: Setting 1 (External Library, spectrum-consistency reranking against a curated external spectral library), which characterizes the upper-bound performance attainable when high-quality external spectral resources are available; and Setting 2 (Self-Constructed Library), in which the reference library is bootstrapped entirely from high-confidence in-batch de novo predictions on the test data itself, placing ScopeNovo under the same resource assumptions as the baselines and yielding a direct comparison. In each column, the best value among the baselines and ScopeNovo (Setting 2) is in bold; ScopeNovo (Setting 1) is reported separately for reference and excluded from the bold comparison.
|
Nine-species benchmark original (DeepNovo, 2017) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| Casanovo | 0.788 | 0.676 | 0.708 | 0.676 | 0.754 | 0.765 | 0.761 | 0.792 | 0.756 | 0.743 |
| Casanovo V2 | 0.801 | 0.687 | 0.721 | 0.687 | 0.767 | 0.774 | 0.768 | 0.802 | 0.768 | 0.754 |
| InstaNovo | 0.802 | 0.656 | 0.718 | 0.691 | 0.756 | 0.742 | 0.794 | 0.774 | 0.767 | 0.745 |
| ContraNovo | 0.828 | 0.700 | 0.764 | 0.778 | 0.798 | 0.803 | 0.804 | 0.812 | 0.787 | 0.785 |
| AdaNovo | 0.858 | 0.798 | 0.767 | 0.690 | 0.804 | 0.778 | 0.878 | 0.818 | 0.791 | 0.798 |
| RankNovo | 0.807 | 0.771 | 0.880 | 0.784 | 0.838 | 0.823 | 0.876 | 0.846 | 0.828 | 0.827 |
| π-PrimeNovo | 0.840 | 0.715 | 0.767 | 0.725 | 0.799 | 0.797 | 0.823 | 0.822 | 0.795 | 0.789 |
| ScopeNovo Setting 1 | 0.849 | 0.715 | 0.778 | 0.729 | 0.811 | 0.809 | 0.816 | 0.825 | 0.796 | 0.797 |
| ScopeNovo Setting 2 | 0.844 | 0.722 | 0.774 | 0.732 | 0.806 | 0.809 | 0.829 | 0.828 | 0.798 | 0.795 |
|
Nine-species benchmark original (DeepNovo, 2017) |
Peptide accuracy | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| Casanovo | 0.621 | 0.437 | 0.494 | 0.446 | 0.568 | 0.485 | 0.593 | 0.622 | 0.601 | 0.551 |
| Casanovo V2 | 0.630 | 0.445 | 0.504 | 0.455 | 0.579 | 0.493 | 0.600 | 0.629 | 0.607 | 0.559 |
| InstaNovo | 0.652 | 0.459 | 0.535 | 0.515 | 0.595 | 0.525 | 0.635 | 0.635 | 0.618 | 0.582 |
| ContraNovo | 0.688 | 0.486 | 0.580 | 0.625 | 0.633 | 0.574 | 0.678 | 0.674 | 0.673 | 0.628 |
| AdaNovo | 0.753 | 0.638 | 0.620 | 0.494 | 0.671 | 0.546 | 0.797 | 0.684 | 0.660 | 0.660 |
| RankNovo | 0.765 | 0.592 | 0.642 | 0.621 | 0.688 | 0.595 | 0.765 | 0.720 | 0.726 | 0.687 |
| π-PrimeNovo | 0.725 | 0.532 | 0.602 | 0.575 | 0.654 | 0.572 | 0.701 | 0.701 | 0.703 | 0.650 |
| ScopeNovo Setting 1 | 0.789 | 0.610 | 0.665 | 0.628 | 0.731 | 0.660 | 0.755 | 0.752 | 0.744 | 0.711 |
| ScopeNovo Setting 2 | 0.749 | 0.572 | 0.643 | 0.624 | 0.690 | 0.637 | 0.733 | 0.732 | 0.721 | 0.684 |
The paper bolds the best of the baselines and ScopeNovo (Setting 2) only: 'ScopeNovo (Setting 1) is reported separately for reference and excluded from the bold comparison.' Bold and underline here rank every row, Setting 1 included; the paper's own marks were checked against its rule, and match it.
MassNet: billion-scale AI-ready mass spectral corpus empowering scalable deep learning in proteomics (2026) · 4 tables
Fig. 4b
MassNet: billion-scale AI-ready mass spectral corpus empowering scalable deep learning in proteomics, page 7: Comparison of XuanjiNovo and existing de novo peptide sequencing models on the 15-species benchmark dataset. b, Cross-species peptide recall aggregated by species, illustrating overall performance differences across taxa.
|
15-species benchmark Nature Methods (307 files) |
Peptide recall | |||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Acinetobacter calcoaceticus | Aedes aegypti | Arabidopsis thaliana | Aspergillus fumigatus | Bacteroides thetaiotaomicron | Drosophila melanogaster | Escherichia coli | Homo sapiens | Mus musculus | Pyrococcus furiosus | Saccharomyces cerevisiae | Toxoplasma gondii | |
| π-HelixNovo · released | 0.41 | 0.403 | 0.183 | 0.286 | 0.413 | 0.188 | 0.114 | 0.184 | 0.307 | 0.398 | 0.386 | 0.186 |
| Casanovo V2 · released | 0.6 | 0.57 | 0.266 | 0.395 | 0.652 | 0.319 | 0.329 | 0.224 | 0.458 | 0.516 | 0.598 | 0.262 |
| InstaNovo+ · released | 0.632 | 0.606 | 0.262 | 0.412 | 0.661 | 0.346 | 0.345 | 0.259 | 0.524 | 0.545 | 0.6 | 0.241 |
| ContraNovo | 0.654 | 0.615 | 0.283 | 0.436 | 0.678 | 0.373 | 0.368 | 0.299 | 0.54 | 0.544 | 0.626 | 0.277 |
| XuanjiNovo | 0.779 | 0.757 | 0.333 | 0.582 | 0.793 | 0.444 | 0.476 | 0.449 | 0.676 | 0.668 | 0.691 | 0.355 |
| π-PrimeNovo | 0.733 | 0.686 | 0.323 | 0.51 | 0.78 | 0.429 | 0.466 | 0.324 | 0.604 | 0.616 | 0.692 | 0.308 |
|
15-species benchmark Nature Methods (307 files) |
Peptide recall | ||
|---|---|---|---|
| Trypanosoma brucei | Zea mays | Solanum lycopersicum | |
| π-HelixNovo · released | 0.348 | 0.443 | 0.001 |
| Casanovo V2 · released | 0.588 | 0.557 | 0.011 |
| InstaNovo+ · released | 0.623 | 0.649 | 0.004 |
| ContraNovo | 0.641 | 0.653 | 0.062 |
| XuanjiNovo | 0.762 | 0.799 | 0.252 |
| π-PrimeNovo | 0.738 | 0.731 | 0.06 |
Read from the paper's source data: every value is a cell of 'Source Data.xlsx', sheet Figure4B, behind a figure that prints no values. Nothing was estimated from bar heights. Values from the paper's Source Data file (sheet Figure4B); the figure prints none. XuanjiNovo is XuanjiNovo-100M, per the caption. THE TEXT AND THE SHEET DISAGREE once: p. 5 says the other models on S. lycopersicum ranged 'from as low as 0.01 (π-HelixNovo)', the sheet gives 0.001.
Supplementary Fig. 3c
MassNet: billion-scale AI-ready mass spectral corpus empowering scalable deep learning in proteomics, page 5: Evaluation of de novo peptide sequencing performance on other benchmark datasets. (A) Peptide recall across nine species using seven models: InstaNovo+, π-HelixNovo, ContraNovo, CasaNovo V2, π-PrimeNovo, XuanjiNovo-100M, and XuanjiNovo-130M. (B) Peptide recall on the HCC dataset. (C) Peptide recall on the PT dataset. The π-HelixNovo model is publicly available and was trained on datasets derived from eight species, excluding human. XuanjiNovo-100M: base model; XuanjiNovo-130M: fine-tuned on 30M PSMs from MassIVE.
| ProteomeTools | Peptide recall |
|---|---|
| PT | |
| Casanovo V2 | 0.459 |
| InstaNovo+ | 0.479 |
| ContraNovo | 0.574 |
| π-PrimeNovo | 0.586 |
| XuanjiNovo | 0.605 |
Read from the paper's source data: every value is a cell of 'Supplementary Data 1.xlsx', sheet SFigure3C, behind a figure that prints no values. Nothing was estimated from bar heights. Values from Supplementary Data 1 (sheet SFigure3C); the figure prints none. The figure draws six bars and the sheet has five: π-HelixNovo (about 0.26 by its bar) has no row, so it is not recorded. THE TEXT AND THE SHEET DISAGREE: p. 8 says XuanjiNovo-100M 'achieved a recall of 0.62' on PT, the sheet gives 0.605.
Supplementary Fig. 3b
MassNet: billion-scale AI-ready mass spectral corpus empowering scalable deep learning in proteomics, page 5: Evaluation of de novo peptide sequencing performance on other benchmark datasets. (A) Peptide recall across nine species using seven models: InstaNovo+, π-HelixNovo, ContraNovo, CasaNovo V2, π-PrimeNovo, XuanjiNovo-100M, and XuanjiNovo-130M. (B) Peptide recall on the HCC dataset. (C) Peptide recall on the PT dataset. The π-HelixNovo model is publicly available and was trained on datasets derived from eight species, excluding human. XuanjiNovo-100M: base model; XuanjiNovo-130M: fine-tuned on 30M PSMs from MassIVE.
|
Proteomics identifies new therapeutic targets of early-stage hepatocellular carcinoma as deposited |
Peptide recall |
|---|---|
| HCC | |
| Casanovo V2 | 0.168 |
| InstaNovo+ | 0.087 |
| ContraNovo | 0.373 |
| π-PrimeNovo | 0.382 |
| XuanjiNovo | 0.676 |
Read from the paper's source data: every value is a cell of 'Supplementary Data 1.xlsx', sheet SFigure3B, behind a figure that prints no values. Nothing was estimated from bar heights. Values from Supplementary Data 1 (sheet SFigure3B); the figure prints none. The figure draws six bars and the sheet has five: π-HelixNovo, whose bar is barely above zero, has no row, so it is not recorded rather than read off the bar. XuanjiNovo is XuanjiNovo-100M, per the caption of Fig. 4.
Supplementary Fig. 3a
MassNet: billion-scale AI-ready mass spectral corpus empowering scalable deep learning in proteomics, page 5: Evaluation of de novo peptide sequencing performance on other benchmark datasets. (A) Peptide recall across nine species using seven models: InstaNovo+, π-HelixNovo, ContraNovo, CasaNovo V2, π-PrimeNovo, XuanjiNovo-100M, and XuanjiNovo-130M. (B) Peptide recall on the HCC dataset. (C) Peptide recall on the PT dataset. The π-HelixNovo model is publicly available and was trained on datasets derived from eight species, excluding human. XuanjiNovo-100M: base model; XuanjiNovo-130M: fine-tuned on 30M PSMs from MassIVE.
|
Nine-species benchmark original (DeepNovo, 2017) |
Peptide recall | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | |
| π-HelixNovo · released | 0.596 | 0.388 | 0.473 | 0.392 | 0.56 | 0.483 | 0.623 | 0.56 | 0.568 |
| InstaNovo+ | 0.576 | 0.417 | 0.467 | 0.456 | 0.528 | 0.471 | 0.565 | 0.585 | 0.56 |
| Casanovo V2 | 0.622 | 0.446 | 0.499 | 0.455 | 0.565 | 0.486 | 0.594 | 0.624 | 0.598 |
| ContraNovo | 0.688 | 0.487 | 0.576 | 0.622 | 0.63 | 0.566 | 0.677 | 0.672 | 0.674 |
| π-PrimeNovo | 0.721 | 0.531 | 0.603 | 0.574 | 0.65 | 0.567 | 0.702 | 0.697 | 0.697 |
| XuanjiNovo 100M | 0.43 | 0.393 | 0.435 | 0.589 | 0.468 | 0.502 | 0.499 | 0.536 | 0.407 |
| XuanjiNovo 130M | 0.689 | 0.503 | 0.574 | 0.6 | 0.628 | 0.682 | 0.595 | 0.681 | 0.67 |
Read from the paper's source data: every value is a cell of 'Supplementary Data 1.xlsx', sheet SFigure3A, behind a figure that prints no values. Nothing was estimated from bar heights. Values from the paper's Supplementary Data 1 (sheet SFigure3A); the figure prints none. The sheet names InstaNovo where the legend draws InstaNovo+. THE TEXT AND THE SHEET DISAGREE once: p. 8 puts XuanjiNovo-130M on M. musculus at 'approximately 0.67', the sheet at 0.682.
dIon: Fragmentation-Based Invariance for Self-Supervised Learning of Tandem Mass Spectra (2026) · 4 tables
Table 26
dIon: Fragmentation-Based Invariance for Self-Supervised Learning of Tandem Mass Spectra, page 33: Complete MSKB-final de novo results, including amino-acid metrics and the dIoninitialized models fine-tuned with a 1,000-peak cap. Within each training regime, scratch and dIon initialization use an identical end-to-end training protocol.
|
Casanovo digestion enzyme bias data as deposited |
Amino acid precision | Amino acid recall | Peptide precision at coverage 1 |
|---|---|---|---|
| dIon from scratch, end-to-end; trained on MSKB-final | 0.895 | 0.895 | 0.747 |
| dIon init., end-to-end; trained on MSKB-final | 0.927 | 0.926 | 0.802 |
| dIon init., end-to-end, 1,000 peaks; trained on MSKB-final | 0.935 | 0.934 | 0.822 |
| dIon from scratch, end-to-end; trained on DNL-v1 | 0.933 | 0.934 | 0.819 |
| dIon init., end-to-end; trained on DNL-v1 | 0.945 | 0.945 | 0.842 |
| dIon init., end-to-end, 1,000 peaks; trained on DNL-v1 | 0.949 | 0.949 | 0.856 |
| Casanovo 5.2.1 · released | 0.911 | 0.912 | 0.783 |
| InstaNovo 1.2.2 · released | 0.961 | 0.961 | 0.916 |
MSKB-final, rows grouped by training corpus as in Table 1. InstaNovo 1.2.2 is printed in grey with an asterisk because it 'is documented as training on MassIVE-KB v1, the source corpus of this test set', so its numbers are not a held-out evaluation.
In the paper: column amino acid precision: the original table bolded dIon init., end-to-end, 1,000 peaks; trained on DNL-v1 (0.949).
In the paper: column peptide precision at coverage 1: the original table bolded dIon init., end-to-end, 1,000 peaks; trained on DNL-v1 (0.856).
In the paper: column amino acid recall: the original table bolded dIon init., end-to-end, 1,000 peaks; trained on DNL-v1 (0.949).
Table25
dIon: Fragmentation-Based Invariance for Self-Supervised Learning of Tandem Mass Spectra, page 32: Per-species peptide precision at full coverage on the Kingdoms de novo test set (deterministic run-disjoint split, at most 100k spectra per species).
| The Proteome Landscape of the Kingdoms of Life | Peptide precision at coverage 1 | |||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Akkermansia muciniphila | Arabidopsis thaliana (callus) | Arabidopsis thaliana (root) | Arabidopsis thaliana (sprout) | Bacillus subtilis | Bacteroides fragilis | Bacteroides thetaiotaomicron | Bacteroides uniformis | Bacteroides vulgatus | Bifidobacterium adolescentis | Bifidobacterium longum subsp. longum | Blautia obeum | |
| dIon init.; DNL-v1, 200 peaks | 0.584 | 0.617 | 0.620 | 0.652 | 0.559 | 0.631 | 0.607 | 0.632 | 0.612 | 0.563 | 0.525 | 0.606 |
| dIon from scratch; DNL-v1, 200 peaks | 0.535 | 0.573 | 0.574 | 0.605 | 0.527 | 0.583 | 0.561 | 0.585 | 0.562 | 0.519 | 0.487 | 0.554 |
| Casanovo 5.2.1 · released | 0.487 | 0.528 | 0.510 | 0.537 | 0.506 | 0.505 | 0.493 | 0.512 | 0.491 | 0.471 | 0.451 | 0.502 |
| InstaNovo 1.2.2 · released | 0.546 | 0.586 | 0.581 | 0.620 | 0.546 | 0.574 | 0.554 | 0.576 | 0.554 | 0.537 | 0.503 | 0.572 |
| The Proteome Landscape of the Kingdoms of Life | Peptide precision at coverage 1 | |||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Bos taurus | Caenorhabditis elegans | Canis lupus | Chlamydomonas reinhardtii | Chromera velia | Clostridium bolteae | Clostridium perfringens | Clostridium saccharolyticum | Collinsella aerofaciens | Coprococcus comes | Cricetulus griseus | Danio rerio | |
| dIon init.; DNL-v1, 200 peaks | 0.672 | 0.633 | 0.631 | 0.537 | 0.535 | 0.587 | 0.642 | 0.608 | 0.570 | 0.612 | 0.551 | 0.603 |
| dIon from scratch; DNL-v1, 200 peaks | 0.617 | 0.584 | 0.576 | 0.504 | 0.492 | 0.534 | 0.594 | 0.556 | 0.525 | 0.560 | 0.500 | 0.554 |
| Casanovo 5.2.1 · released | 0.540 | 0.519 | 0.504 | 0.476 | 0.450 | 0.485 | 0.538 | 0.502 | 0.475 | 0.500 | 0.451 | 0.485 |
| InstaNovo 1.2.2 · released | 0.649 | 0.600 | 0.607 | 0.520 | 0.519 | 0.553 | 0.600 | 0.570 | 0.538 | 0.569 | 0.545 | 0.575 |
| The Proteome Landscape of the Kingdoms of Life | Peptide precision at coverage 1 | |||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Dictyostelium discoideum | Didelphis didelphinae | Dorea formicigenerans | Drosophila melanogaster | Eggerthella lenta | Emiliania huxleyi | Escherichia coli | Eubacterium rectale | Fusarium oxysporum | Fusobacterium nucleatum subsp. nucleatum | Gallus gallus | Glycine max | |
| dIon init.; DNL-v1, 200 peaks | 0.622 | 0.645 | 0.555 | 0.640 | 0.519 | 0.560 | 0.619 | 0.564 | 0.494 | 0.641 | 0.659 | 0.608 |
| dIon from scratch; DNL-v1, 200 peaks | 0.566 | 0.589 | 0.514 | 0.586 | 0.462 | 0.515 | 0.567 | 0.516 | 0.457 | 0.594 | 0.607 | 0.561 |
| Casanovo 5.2.1 · released | 0.476 | 0.508 | 0.485 | 0.501 | 0.408 | 0.449 | 0.495 | 0.467 | 0.438 | 0.538 | 0.528 | 0.494 |
| InstaNovo 1.2.2 · released | 0.569 | 0.611 | 0.530 | 0.596 | 0.482 | 0.530 | 0.573 | 0.521 | 0.476 | 0.599 | 0.622 | 0.573 |
| The Proteome Landscape of the Kingdoms of Life | Peptide precision at coverage 1 | |||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Gossypium hirsutum | Guillardia theta | Haloarcula marismortui | Halobacterium sp. | Homo sapiens | Lactobacillus paracasei | Mus musculus | Mycoplasma intracellular | Neurospora crassa | Odoribacter splanchnicus | Oryctolagus cuniculus | Oryzias melastigma | |
| dIon init.; DNL-v1, 200 peaks | 0.607 | 0.579 | 0.652 | 0.556 | 0.679 | 0.586 | 0.611 | 0.761 | 0.553 | 0.598 | 0.648 | 0.593 |
| dIon from scratch; DNL-v1, 200 peaks | 0.560 | 0.533 | 0.616 | 0.522 | 0.624 | 0.541 | 0.555 | 0.698 | 0.511 | 0.552 | 0.582 | 0.539 |
| Casanovo 5.2.1 · released | 0.504 | 0.472 | 0.581 | 0.489 | 0.543 | 0.489 | 0.479 | 0.636 | 0.461 | 0.500 | 0.497 | 0.471 |
| InstaNovo 1.2.2 · released | 0.575 | 0.550 | 0.589 | 0.518 | 0.662 | 0.554 | 0.596 | 0.743 | 0.522 | 0.551 | 0.611 | 0.557 |
| The Proteome Landscape of the Kingdoms of Life | Peptide precision at coverage 1 | |||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Parabacteroides distasonis | Parabacteroides merdae | Phaeodactylum tricornutum | Porphyra umbilicalis | Prevotella copri | Rattus norvegicus | Roseburia intestinalis | Ruminococcus bromii | Ruminococcus gnavus | Ruminococcus torques | Saccharomyces cerevisiae | Stentor coeruleus | |
| dIon init.; DNL-v1, 200 peaks | 0.637 | 0.627 | 0.555 | 0.617 | 0.646 | 0.580 | 0.522 | 0.595 | 0.623 | 0.649 | 0.650 | 0.615 |
| dIon from scratch; DNL-v1, 200 peaks | 0.585 | 0.577 | 0.511 | 0.574 | 0.598 | 0.531 | 0.476 | 0.549 | 0.573 | 0.600 | 0.602 | 0.562 |
| Casanovo 5.2.1 · released | 0.523 | 0.520 | 0.457 | 0.497 | 0.537 | 0.482 | 0.445 | 0.505 | 0.505 | 0.530 | 0.517 | 0.486 |
| InstaNovo 1.2.2 · released | 0.588 | 0.577 | 0.532 | 0.583 | 0.599 | 0.580 | 0.497 | 0.562 | 0.578 | 0.604 | 0.602 | 0.572 |
| The Proteome Landscape of the Kingdoms of Life | Peptide precision at coverage 1 | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Streptococcus parasanguinis | Sulfolobus solfataricus | Sus scrofa | Symbiodinium microadriaticum | Synechocystis nigrescens | Tardigrade | Thalassiosira pseudonana | Triticum aestivum | Veillonella parvula | Vitis vinifera | |
| dIon init.; DNL-v1, 200 peaks | 0.627 | 0.567 | 0.577 | 0.551 | 0.652 | 0.618 | 0.562 | 0.616 | 0.554 | 0.581 |
| dIon from scratch; DNL-v1, 200 peaks | 0.577 | 0.514 | 0.525 | 0.510 | 0.615 | 0.564 | 0.515 | 0.569 | 0.509 | 0.543 |
| Casanovo 5.2.1 · released | 0.518 | 0.473 | 0.462 | 0.477 | 0.577 | 0.493 | 0.454 | 0.488 | 0.454 | 0.510 |
| InstaNovo 1.2.2 · released | 0.583 | 0.543 | 0.572 | 0.546 | 0.633 | 0.578 | 0.531 | 0.577 | 0.511 | 0.559 |
Peptide precision at full coverage per species of dIon's Kingdoms de novo test split. The 'Spectra' column, the number of test spectra per species, is not recorded as a measurement.
Table1 (MSKB-final)
dIon: Fragmentation-Based Invariance for Self-Supervised Learning of Tandem Mass Spectra, page 7: De novo sequencing on the Kingdoms de novo (all 70 species) and MSKB-final test sets. Within each training regime, scratch and dIon initialization use an identical end-to-end training protocol.
|
Casanovo digestion enzyme bias data as deposited |
Peptide precision at coverage 1 |
|---|---|
| MSKB-final | |
| dIon from scratch, end-to-end; trained on MSKB-final | 0.747 |
| dIon init., end-to-end; trained on MSKB-final | 0.802 |
| dIon from scratch, end-to-end; trained on DNL-v1 | 0.819 |
| dIon init., end-to-end; trained on DNL-v1 | 0.842 |
| Casanovo 5.2.1 · released | 0.783 |
Peptide precision here is at FULL coverage, unanswered spectra counted wrong, which is Casanovo's precision at coverage 1. Rows are grouped by training corpus, recorded in each variant. InstaNovo 1.2.2 has no MSKB-final value: it 'was trained on MassIVE-KB v1, the source of this test set'.
Table1 (Kingdoms de novo)
dIon: Fragmentation-Based Invariance for Self-Supervised Learning of Tandem Mass Spectra, page 7: De novo sequencing on the Kingdoms de novo (all 70 species) and MSKB-final test sets. Within each training regime, scratch and dIon initialization use an identical end-to-end training protocol.
| The Proteome Landscape of the Kingdoms of Life | Peptide precision at coverage 1 |
|---|---|
| Kingdoms | |
| dIon from scratch, end-to-end; trained on MSKB-final | 0.449 |
| dIon init., end-to-end; trained on MSKB-final | 0.533 |
| dIon from scratch, end-to-end; trained on DNL-v1 | 0.554 |
| dIon init., end-to-end; trained on DNL-v1 | 0.602 |
| Casanovo 5.2.1 · released | 0.492 |
| InstaNovo 1.2.2 · released | 0.570 |
Peptide precision here is at FULL coverage, unanswered spectra counted wrong, which is Casanovo's precision at coverage 1. Rows are grouped by training corpus, recorded in each variant. InstaNovo 1.2.2 has no MSKB-final value: it 'was trained on MassIVE-KB v1, the source of this test set'.
GyroNovo: Error-Guided Fragment Imputation with Mass-Aware Attention for De Novo Peptide Sequencing (2026) · 6 tables
Table2 (Seven-species)
GyroNovo: Error-Guided Fragment Imputation with Mass-Aware Attention for De Novo Peptide Sequencing, page 7: PTM-levelperformanceontheNine-Species,SevenSpecies, and HC-PT datasets. Best results are shown in bold.
|
Seven-species benchmark NovoBench split |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · quoted | 0.391 | 0.373 |
| PointNovo · quoted | 0.117 | 0.094 |
| InstaNovo · quoted | 0.126 | 0.115 |
| Casanovo · quoted | 0.360 | 0.251 |
| AdaNovo · quoted | 0.448 | 0.321 |
| LIPNovo · quoted | 0.604 | 0.498 |
| LIPNovo+ · quoted | 0.648 | 0.561 |
| LIPNovo reproduced · retrained | 0.602 | 0.500 |
| GyroNovo | 0.665 | 0.565 |
Table2 (Nine-species)
GyroNovo: Error-Guided Fragment Imputation with Mass-Aware Attention for De Novo Peptide Sequencing, page 7: PTM-levelperformanceontheNine-Species,SevenSpecies, and HC-PT datasets. Best results are shown in bold.
| Nine-species benchmark | Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · quoted | 0.576 | 0.529 |
| PointNovo · quoted | 0.629 | 0.546 |
| InstaNovo · quoted | 0.443 | 0.294 |
| Casanovo · quoted | 0.706 | 0.566 |
| AdaNovo · quoted | 0.652 | 0.570 |
| LIPNovo · quoted | 0.765 | 0.656 |
| LIPNovo+ · quoted | 0.801 | 0.678 |
| LIPNovo reproduced · retrained | 0.773 | 0.646 |
| GyroNovo | 0.815 | 0.731 |
Table2 (HC-PT)
GyroNovo: Error-Guided Fragment Imputation with Mass-Aware Attention for De Novo Peptide Sequencing, page 7: PTM-levelperformanceontheNine-Species,SevenSpecies, and HC-PT datasets. Best results are shown in bold.
|
ProteomeTools HC-PT (NovoBench) |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · quoted | 0.626 | 0.615 |
| PointNovo · quoted | 0.676 | 0.740 |
| InstaNovo · quoted | 0.350 | 0.261 |
| Casanovo · quoted | 0.501 | 0.460 |
| AdaNovo · quoted | 0.552 | 0.482 |
| LIPNovo · quoted | 0.732 | 0.745 |
| LIPNovo+ · quoted | 0.757 | 0.805 |
| LIPNovo reproduced · retrained | 0.690 | 0.762 |
| GyroNovo | 0.790 | 0.817 |
Table1 (Seven-species)
GyroNovo: Error-Guided Fragment Imputation with Mass-Aware Attention for De Novo Peptide Sequencing, page 7: Amino-acid- and peptide-level performance on the Nine-Species, Seven-Species, and HC-PT datasets. Best results are shown in bold.
|
Seven-species benchmark NovoBench split |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| DeepNovo · quoted | 0.492 | 0.433 | 0.204 | 0.136 |
| PointNovo · quoted | 0.196 | 0.169 | 0.022 | 0.007 |
| Casanovo · quoted | 0.322 | 0.327 | 0.119 | 0.084 |
| AdaNovo · quoted | 0.379 | 0.385 | 0.174 | 0.135 |
| InstaNovo · quoted | 0.192 | 0.176 | 0.031 | 0.009 |
| LIPNovo · quoted | 0.557 | 0.560 | 0.327 | 0.281 |
| LIPNovo+ · quoted | 0.619 | 0.622 | 0.383 | 0.337 |
| LIPNovo reproduced · retrained | 0.553 | 0.554 | 0.325 | 0.270 |
| GyroNovo | 0.632 | 0.635 | 0.421 | 0.378 |
Table1 (Nine-species)
GyroNovo: Error-Guided Fragment Imputation with Mass-Aware Attention for De Novo Peptide Sequencing, page 7: Amino-acid- and peptide-level performance on the Nine-Species, Seven-Species, and HC-PT datasets. Best results are shown in bold.
| Nine-species benchmark | Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| PEAKS · quoted | 0.748 | 0.428 | ||
| DeepNovo · quoted | 0.696 | 0.638 | 0.428 | 0.376 |
| PointNovo · quoted | 0.740 | 0.671 | 0.480 | 0.436 |
| Casanovo · quoted | 0.697 | 0.696 | 0.481 | 0.439 |
| AdaNovo · quoted | 0.698 | 0.709 | 0.505 | 0.469 |
| InstaNovo · quoted | 0.420 | 0.395 | 0.164 | 0.123 |
| LIPNovo · quoted | 0.797 | 0.797 | 0.582 | 0.547 |
| LIPNovo+ · quoted | 0.831 | 0.831 | 0.637 | 0.612 |
| LIPNovo reproduced · retrained | 0.794 | 0.796 | 0.583 | 0.549 |
| GyroNovo | 0.848 | 0.848 | 0.674 | 0.646 |
Table1 (HC-PT)
GyroNovo: Error-Guided Fragment Imputation with Mass-Aware Attention for De Novo Peptide Sequencing, page 7: Amino-acid- and peptide-level performance on the Nine-Species, Seven-Species, and HC-PT datasets. Best results are shown in bold.
|
ProteomeTools HC-PT (NovoBench) |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| DeepNovo · quoted | 0.531 | 0.534 | 0.313 | 0.255 |
| PointNovo · quoted | 0.623 | 0.622 | 0.419 | 0.373 |
| Casanovo · quoted | 0.442 | 0.453 | 0.211 | 0.177 |
| AdaNovo · quoted | 0.442 | 0.451 | 0.212 | 0.178 |
| InstaNovo · quoted | 0.289 | 0.285 | 0.057 | 0.034 |
| LIPNovo · quoted | 0.637 | 0.643 | 0.458 | 0.427 |
| LIPNovo+ · quoted | 0.698 | 0.694 | 0.519 | 0.490 |
| LIPNovo reproduced · retrained | 0.653 | 0.654 | 0.469 | 0.438 |
| GyroNovo | 0.704 | 0.702 | 0.532 | 0.502 |
Learning from tandem mass spectra at scale with a self-supervised foundation model for proteomics (2026) · 1 table
Table S12
Learning from tandem mass spectra at scale with a self-supervised foundation model for proteomics, page 84: Peptide recall across the biological validation datasets for the de novo sequencing benchmark. The best model per dataset is in bold.
| a dataset per evaluation set | Peptide recall | |||||
|---|---|---|---|---|---|---|
| HeLa degradome | Candidatus Scalindua brodae | Snake venoms | HeLa single-shot | Nanobodies | Wound exudates | |
| InstaNovo-FM fine-tuned | 0.821 | 0.740 | 0.230 | 0.662 | 0.528 | 0.366 |
| InstaNovo v1.2 | 0.868 | 0.764 | 0.227 | 0.708 | 0.517 | 0.431 |
| Casanovo | 0.767 | 0.743 | 0.217 | 0.531 | 0.465 | 0.262 |
| XuanjiNovo | 0.808 | 0.741 | 0.233 | 0.673 | 0.529 | 0.466 |
No accession is printed for the six validation sets. They are mapped from the Methods, which call them InstaNovo's application datasets minus 'the Immuno and Herceptin datasets': GluC is InstaNovo's 'HeLa GluC degradome', TPL Antibodies its nanobodies, and Hela QC, by elimination, its HeLa single-shot set.
Discrete Diffusion with Physical Mass Constraints for De Novo Peptide Sequencing (2026) · 8 tables
Table5
Discrete Diffusion with Physical Mass Constraints for De Novo Peptide Sequencing, page 8: Comparison of inference speed and accuracy. PhysNovo enables a flexible speed–accuracy trade-off by adjusting the number of denoising steps (T).
| not stated; page mentions Nine-species benchmark, ProteomeTools, Seven-species benchmark | Amino acid precision |
|---|---|
| Casanovo AR · retrained | 0.697 |
| π-PrimeNovo NAR | 0.790 |
| PhysNovo T = 100 | 0.815 |
| PhysNovo T = 50 | 0.801 |
Table4
Discrete Diffusion with Physical Mass Constraints for De Novo Peptide Sequencing, page 8: Comparison of parameter efficiency and task performance.
Table2 (Seven-species)
Discrete Diffusion with Physical Mass Constraints for De Novo Peptide Sequencing, page 7: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in PTM-level performance.
|
Seven-species benchmark NovoBench split |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · retrained | 0.391 | 0.373 |
| PointNovo · retrained | 0.117 | 0.094 |
| InstaNovo · retrained | 0.126 | 0.115 |
| Casanovo · retrained | 0.360 | 0.251 |
| AdaNovo · retrained | 0.448 | 0.321 |
| π-HelixNovo · retrained | 0.473 | 0.366 |
| LIPNovo · retrained | 0.604 | 0.498 |
| PhysNovo | 0.654 | 0.549 |
Table2 (Nine-species)
Discrete Diffusion with Physical Mass Constraints for De Novo Peptide Sequencing, page 7: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in PTM-level performance.
|
Nine-species benchmark revised (balanced) |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · retrained | 0.576 | 0.529 |
| PointNovo · retrained | 0.629 | 0.546 |
| InstaNovo · retrained | 0.443 | 0.294 |
| Casanovo · retrained | 0.706 | 0.566 |
| AdaNovo · retrained | 0.652 | 0.570 |
| π-HelixNovo · retrained | 0.680 | 0.598 |
| LIPNovo · retrained | 0.765 | 0.656 |
| PhysNovo | 0.793 | 0.686 |
Table2 (HC-PT)
Discrete Diffusion with Physical Mass Constraints for De Novo Peptide Sequencing, page 7: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in PTM-level performance.
|
ProteomeTools HC-PT (NovoBench) |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · retrained | 0.626 | 0.615 |
| PointNovo · retrained | 0.676 | 0.740 |
| InstaNovo · retrained | 0.350 | 0.261 |
| Casanovo · retrained | 0.501 | 0.460 |
| AdaNovo · retrained | 0.552 | 0.482 |
| π-HelixNovo · retrained | 0.568 | 0.667 |
| LIPNovo · retrained | 0.732 | 0.745 |
| PhysNovo | 0.763 | 0.770 |
Table1 (Seven-species)
Discrete Diffusion with Physical Mass Constraints for De Novo Peptide Sequencing, page 7: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in amino acid-level and peptidelevel performance. The best results are marked in bold, and the second best are underlined.
|
Seven-species benchmark NovoBench split |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| DeepNovo · retrained | 0.492 | 0.433 | 0.204 | 0.136 |
| PointNovo · retrained | 0.196 | 0.169 | 0.022 | 0.007 |
| InstaNovo · retrained | 0.192 | 0.176 | 0.031 | 0.009 |
| Casanovo · retrained | 0.322 | 0.327 | 0.119 | 0.084 |
| AdaNovo · retrained | 0.379 | 0.385 | 0.174 | 0.135 |
| π-HelixNovo · retrained | 0.481 | 0.472 | 0.234 | 0.173 |
| LIPNovo · retrained | 0.557 | 0.560 | 0.327 | 0.281 |
| ReNovo | 0.512 | 0.514 | 0.278 | 0.228 |
| PhysNovo | 0.568 | 0.569 | 0.346 | 0.290 |
Table1 (Nine-species)
Discrete Diffusion with Physical Mass Constraints for De Novo Peptide Sequencing, page 7: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in amino acid-level and peptidelevel performance. The best results are marked in bold, and the second best are underlined.
|
Nine-species benchmark revised (balanced) |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| PEAKS | 0.748 | 0.428 | ||
| DeepNovo · retrained | 0.696 | 0.638 | 0.428 | 0.376 |
| PointNovo · retrained | 0.740 | 0.671 | 0.480 | 0.436 |
| InstaNovo · retrained | 0.420 | 0.395 | 0.164 | 0.123 |
| Casanovo · retrained | 0.697 | 0.696 | 0.481 | 0.439 |
| AdaNovo · retrained | 0.698 | 0.709 | 0.505 | 0.469 |
| π-HelixNovo · retrained | 0.765 | 0.758 | 0.517 | 0.453 |
| LIPNovo · retrained | 0.797 | 0.797 | 0.582 | 0.547 |
| π-PrimeNovo | 0.790 | |||
| ReNovo | 0.770 | 0.769 | 0.568 | 0.528 |
| PhysNovo | 0.815 | 0.814 | 0.588 | 0.553 |
Table1 (HC-PT)
Discrete Diffusion with Physical Mass Constraints for De Novo Peptide Sequencing, page 7: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in amino acid-level and peptidelevel performance. The best results are marked in bold, and the second best are underlined.
|
ProteomeTools HC-PT (NovoBench) |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| DeepNovo · retrained | 0.531 | 0.534 | 0.313 | 0.255 |
| PointNovo · retrained | 0.623 | 0.622 | 0.419 | 0.373 |
| InstaNovo · retrained | 0.289 | 0.285 | 0.057 | 0.034 |
| Casanovo · retrained | 0.442 | 0.453 | 0.211 | 0.177 |
| AdaNovo · retrained | 0.442 | 0.451 | 0.212 | 0.178 |
| π-HelixNovo · retrained | 0.588 | 0.582 | 0.356 | 0.318 |
| LIPNovo · retrained | 0.637 | 0.643 | 0.458 | 0.427 |
| ReNovo | 0.651 | 0.648 | 0.467 | 0.436 |
| PhysNovo | 0.649 | 0.652 | 0.473 | 0.444 |
MemNovo: Look Back at the Spectrum for Balanced De Novo Peptide Sequencing from Mass Spectrometry (2026) · 1 table
Table2
MemNovo: Look Back at the Spectrum for Balanced De Novo Peptide Sequencing from Mass Spectrometry, page 7: Performance comparison on the Nine Species benchmark. We report amino acid precision (AA) and peptide precision (Pep.) for each method. For Casanovo and InstaNovo, we additionally show results with MemNovo applied and the corresponding relative improvement (Rel. Imp.). Best results for each species are shown in bold. Results marked with † are reported from original publications, which may use different model versions and evaluation protocols; direct numerical comparison with our evaluation should be interpreted with caution.
|
Nine-species benchmark revised (balanced) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| DeepNovo · quoted | 0.6230 | 0.6100 | 0.7500 | 0.6940 | 0.6300 | 0.7310 | 0.6790 | 0.7420 | 0.6020 | 0.6734 |
| PointNovo · quoted | 0.6260 | 0.6060 | 0.7790 | 0.7120 | 0.6440 | 0.7330 | 0.7300 | 0.7680 | 0.5890 | 0.6874 |
| Casanovo | 0.6352 | 0.6885 | 0.7672 | 0.7253 | 0.6730 | 0.7302 | 0.7446 | 0.7701 | 0.6895 | 0.7137 |
| AdaNovo · quoted | 0.6460 | 0.6180 | 0.7930 | 0.7280 | 0.6500 | 0.7400 | 0.7190 | 0.7390 | 0.6420 | 0.6972 |
| InstaNovo | 0.7351 | 0.7934 | 0.8447 | 0.8214 | 0.7754 | 0.8181 | 0.8450 | 0.8367 | 0.7631 | 0.8037 |
| MemNovo on Casanovo | 0.6524 | 0.7031 | 0.7688 | 0.7287 | 0.7749 | 0.7442 | 0.7469 | 0.7941 | 0.7055 | 0.7354 |
| MemNovo on InstaNovo | 0.7614 | 0.8130 | 0.8553 | 0.8350 | 0.7934 | 0.8324 | 0.8566 | 0.8504 | 0.7912 | 0.8210 |
|
Nine-species benchmark revised (balanced) |
Peptide precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| DeepNovo · quoted | 0.2860 | 0.2930 | 0.4620 | 0.4220 | 0.3300 | 0.4540 | 0.4360 | 0.4490 | 0.2530 | 0.3761 |
| PointNovo · quoted | 0.3550 | 0.3510 | 0.5340 | 0.4780 | 0.3960 | 0.5130 | 0.5110 | 0.5180 | 0.2980 | 0.4393 |
| Casanovo | 0.2404 | 0.3105 | 0.4089 | 0.3254 | 0.2875 | 0.3873 | 0.3314 | 0.3585 | 0.2274 | 0.3197 |
| AdaNovo · quoted | 0.4670 | 0.3730 | 0.5930 | 0.4960 | 0.4310 | 0.5300 | 0.5460 | 0.5280 | 0.3720 | 0.4818 |
| InstaNovo | 0.3485 | 0.4562 | 0.5559 | 0.4927 | 0.4318 | 0.5116 | 0.5177 | 0.5185 | 0.3435 | 0.4640 |
| MemNovo on Casanovo | 0.3372 | 0.4541 | 0.4968 | 0.4295 | 0.5226 | 0.5250 | 0.3530 | 0.5309 | 0.3529 | 0.4447 |
| MemNovo on InstaNovo | 0.3522 | 0.4675 | 0.5981 | 0.5051 | 0.4419 | 0.5305 | 0.5481 | 0.5298 | 0.3668 | 0.4822 |
LIPNovo+: Self-Reflective Latent Imputation for Robust De Novo Peptide Sequencing (2026) · 8 tables
Table5
LIPNovo+: Self-Reflective Latent Imputation for Robust De Novo Peptide Sequencing, page 18: Comparison with state-of-the-art methods on GraphNovo dataset [11].
| GraphNovo dataset and checkpoint | Peptide recall | Peptide AUC | Amino acid recall | Amino acid precision |
|---|---|---|---|---|
| PEAKS | 0.475 | 0.758 | 0.775 | |
| Novor | 0.431 | 0.740 | 0.753 | |
| DeepNovo | 0.497 | 0.769 | 0.771 | |
| PointNovo | 0.601 | 0.815 | 0.816 | |
| Casanovo · retrained | 0.605 | 0.684 | 0.684 | |
| GraphNovo | 0.712 | 0.876 | 0.874 | |
| LIPNovo | 0.729 | 0.707 | 0.876 | 0.882 |
| LIPNovo+ | 0.740 | 0.720 | 0.889 | 0.891 |
Table4
LIPNovo+: Self-Reflective Latent Imputation for Robust De Novo Peptide Sequencing, page 17: Leave-one-out cross-validation on the Nine-species dataset.
| Nine-species benchmark | Amino acid precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo retrained · retrained | 0.743 | 0.754 | 0.761 | 0.769 | 0.754 | 0.753 | 0.753 | 0.717 | 0.751 |
| LIPNovo | 0.806 | 0.805 | 0.807 | 0.805 | 0.807 | 0.808 | 0.794 | 0.800 | 0.804 |
| LIPNovo+ | 0.845 | 0.843 | 0.849 | 0.851 | 0.841 | 0.844 | 0.839 | 0.839 | 0.844 |
| Nine-species benchmark | Amino acid recall | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo retrained · retrained | 0.745 | 0.752 | 0.757 | 0.770 | 0.754 | 0.752 | 0.755 | 0.716 | 0.750 |
| LIPNovo | 0.807 | 0.805 | 0.806 | 0.805 | 0.807 | 0.807 | 0.796 | 0.798 | 0.804 |
| LIPNovo+ | 0.844 | 0.842 | 0.848 | 0.851 | 0.840 | 0.843 | 0.839 | 0.838 | 0.843 |
| Nine-species benchmark | Peptide precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo retrained · retrained | 0.559 | 0.544 | 0.554 | 0.575 | 0.558 | 0.558 | 0.549 | 0.506 | 0.550 |
| LIPNovo | 0.607 | 0.591 | 0.606 | 0.596 | 0.596 | 0.607 | 0.577 | 0.577 | 0.595 |
| LIPNovo+ | 0.669 | 0.657 | 0.679 | 0.673 | 0.657 | 0.658 | 0.653 | 0.652 | 0.662 |
| Nine-species benchmark | Peptide AUC | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo retrained · retrained | 0.523 | 0.509 | 0.519 | 0.540 | 0.532 | 0.521 | 0.510 | 0.464 | 0.515 |
| LIPNovo | 0.581 | 0.563 | 0.577 | 0.567 | 0.565 | 0.579 | 0.545 | 0.544 | 0.565 |
| LIPNovo+ | 0.647 | 0.634 | 0.657 | 0.651 | 0.632 | 0.633 | 0.628 | 0.626 | 0.639 |
| Nine-species benchmark | Ptm precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo retrained · retrained | 0.797 | 0.742 | 0.762 | 0.784 | 0.779 | 0.799 | 0.760 | 0.710 | 0.767 |
| LIPNovo | 0.855 | 0.764 | 0.769 | 0.772 | 0.812 | 0.803 | 0.764 | 0.777 | 0.790 |
| LIPNovo+ | 0.888 | 0.776 | 0.816 | 0.835 | 0.827 | 0.834 | 0.841 | 0.824 | 0.830 |
| Nine-species benchmark | Ptm recall | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo retrained · retrained | 0.689 | 0.591 | 0.624 | 0.612 | 0.582 | 0.608 | 0.593 | 0.540 | 0.605 |
| LIPNovo | 0.739 | 0.647 | 0.675 | 0.672 | 0.630 | 0.667 | 0.634 | 0.627 | 0.661 |
| LIPNovo+ | 0.782 | 0.699 | 0.728 | 0.696 | 0.707 | 0.703 | 0.703 | 0.704 | 0.715 |
Table3 (Seven-species)
LIPNovo+: Self-Reflective Latent Imputation for Robust De Novo Peptide Sequencing, page 16: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in PTM-level performance. The best and second-best results are marked in bold and underline, respectively.
|
Seven-species benchmark NovoBench split |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo | 0.391 | 0.373 |
| PointNovo | 0.117 | 0.094 |
| InstaNovo | 0.126 | 0.115 |
| Casanovo · retrained | 0.360 | 0.251 |
| AdaNovo | 0.448 | 0.321 |
| π-HelixNovo | 0.473 | 0.366 |
| SearchNovo | 0.472 | 0.447 |
| Casanovo retrained · retrained | 0.368 | 0.292 |
| LIPNovo | 0.604 | 0.498 |
| LIPNovo+ | 0.648 | 0.561 |
Table3 (Nine-species)
LIPNovo+: Self-Reflective Latent Imputation for Robust De Novo Peptide Sequencing, page 16: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in PTM-level performance. The best and second-best results are marked in bold and underline, respectively.
| Nine-species benchmark | Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo | 0.576 | 0.529 |
| PointNovo | 0.629 | 0.546 |
| InstaNovo | 0.443 | 0.294 |
| Casanovo · retrained | 0.706 | 0.566 |
| AdaNovo | 0.652 | 0.570 |
| π-HelixNovo | 0.680 | 0.598 |
| SearchNovo | 0.764 | 0.599 |
| Casanovo retrained · retrained | 0.755 | 0.601 |
| LIPNovo | 0.765 | 0.656 |
| LIPNovo+ | 0.801 | 0.678 |
Table3 (HC-PT)
LIPNovo+: Self-Reflective Latent Imputation for Robust De Novo Peptide Sequencing, page 16: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in PTM-level performance. The best and second-best results are marked in bold and underline, respectively.
|
ProteomeTools HC-PT (NovoBench) |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo | 0.626 | 0.615 |
| PointNovo | 0.676 | 0.740 |
| InstaNovo | 0.350 | 0.261 |
| Casanovo · retrained | 0.501 | 0.460 |
| AdaNovo | 0.552 | 0.482 |
| π-HelixNovo | 0.568 | 0.667 |
| SearchNovo | 0.715 | 0.772 |
| Casanovo retrained · retrained | 0.550 | 0.582 |
| LIPNovo | 0.732 | 0.745 |
| LIPNovo+ | 0.757 | 0.805 |
In the paper: column ptm recall: the original table underlined SearchNovo (0.772), LIPNovo (0.745).
Table2 (Seven-species)
LIPNovo+: Self-Reflective Latent Imputation for Robust De Novo Peptide Sequencing, page 15: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in amino acid-level and peptide-level performance. The best and second-best results are marked in bold and underline, respectively.
|
Seven-species benchmark NovoBench split |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| DeepNovo | 0.492 | 0.433 | 0.204 | 0.136 |
| PointNovo | 0.196 | 0.169 | 0.022 | 0.007 |
| Casanovo · retrained | 0.322 | 0.327 | 0.119 | 0.084 |
| AdaNovo | 0.379 | 0.385 | 0.174 | 0.135 |
| π-HelixNovo | 0.481 | 0.472 | 0.234 | 0.173 |
| InstaNovo | 0.192 | 0.176 | 0.031 | 0.009 |
| SearchNovo | 0.489 | 0.488 | 0.259 | 0.174 |
| ReNovo | 0.512 | 0.514 | 0.278 | 0.228 |
| DiffuNovo | 0.437 | 0.435 | 0.193 | 0.162 |
| Casanovo retrained · retrained | 0.357 | 0.366 | 0.159 | 0.119 |
| LIPNovo | 0.557 | 0.560 | 0.327 | 0.281 |
| LIPNovo+ | 0.619 | 0.622 | 0.383 | 0.337 |
Table2 (Nine-species)
LIPNovo+: Self-Reflective Latent Imputation for Robust De Novo Peptide Sequencing, page 15: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in amino acid-level and peptide-level performance. The best and second-best results are marked in bold and underline, respectively.
| Nine-species benchmark | Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| PEAKS | 0.748 | 0.428 | ||
| DeepNovo | 0.696 | 0.638 | 0.428 | 0.376 |
| PointNovo | 0.740 | 0.671 | 0.480 | 0.436 |
| Casanovo · retrained | 0.697 | 0.696 | 0.481 | 0.439 |
| AdaNovo | 0.698 | 0.709 | 0.505 | 0.469 |
| π-HelixNovo | 0.765 | 0.758 | 0.517 | 0.453 |
| InstaNovo | 0.420 | 0.395 | 0.164 | 0.123 |
| SearchNovo | 0.748 | 0.746 | 0.550 | 0.489 |
| ReNovo | 0.770 | 0.769 | 0.568 | 0.528 |
| DiffuNovo | 0.791 | 0.789 | 0.565 | 0.536 |
| Casanovo retrained · retrained | 0.741 | 0.740 | 0.529 | 0.493 |
| LIPNovo | 0.797 | 0.797 | 0.582 | 0.547 |
| LIPNovo+ | 0.831 | 0.831 | 0.637 | 0.612 |
Table2 (HC-PT)
LIPNovo+: Self-Reflective Latent Imputation for Robust De Novo Peptide Sequencing, page 15: Comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in amino acid-level and peptide-level performance. The best and second-best results are marked in bold and underline, respectively.
|
ProteomeTools HC-PT (NovoBench) |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| DeepNovo | 0.531 | 0.534 | 0.313 | 0.255 |
| PointNovo | 0.623 | 0.622 | 0.419 | 0.373 |
| Casanovo · retrained | 0.442 | 0.453 | 0.211 | 0.177 |
| AdaNovo | 0.442 | 0.451 | 0.212 | 0.178 |
| π-HelixNovo | 0.588 | 0.582 | 0.356 | 0.318 |
| InstaNovo | 0.289 | 0.285 | 0.057 | 0.034 |
| SearchNovo | 0.652 | 0.658 | 0.447 | 0.413 |
| ReNovo | 0.651 | 0.648 | 0.467 | 0.436 |
| DiffuNovo | 0.654 | 0.654 | 0.458 | 0.434 |
| Casanovo retrained · retrained | 0.525 | 0.530 | 0.324 | 0.290 |
| LIPNovo | 0.637 | 0.643 | 0.458 | 0.427 |
| LIPNovo+ | 0.698 | 0.694 | 0.519 | 0.490 |
In the paper: column amino acid precision: the original table underlined LIPNovo (0.637).
Regressor-guided Diffusion Model for De Novo Peptide Sequencing with Explicit Mass Control (2026) · 6 tables
Table2 (Seven-species)
Regressor-guided Diffusion Model for De Novo Peptide Sequencing with Explicit Mass Control, page 7: The comparison of de novo peptide sequencing performance between our proposed model, DiffuNovo, and other stateof-the-art methods on the three benchmark datasets. We report precision and AUC at the peptide level, and precision and recall at the amino acid level. The best and the second best are highlighted with bold and underline, respectively.
|
Seven-species benchmark NovoBench split |
Peptide precision | Peptide AUC | Amino acid precision | Amino acid recall |
|---|---|---|---|---|
| DeepNovo | 0.204 | 0.136 | 0.492 | 0.433 |
| PointNovo | 0.022 | 0.007 | 0.196 | 0.169 |
| Casanovo | 0.119 | 0.084 | 0.322 | 0.327 |
| AdaNovo | 0.174 | 0.135 | 0.379 | 0.385 |
| π-HelixNovo | 0.234 | 0.173 | 0.481 | 0.472 |
| DiffuNovo Logits | 0.233 | 0.104 | 0.430 | 0.428 |
| DiffuNovo MBR | 0.193 | 0.162 | 0.437 | 0.435 |
Table2 (Nine-species)
Regressor-guided Diffusion Model for De Novo Peptide Sequencing with Explicit Mass Control, page 7: The comparison of de novo peptide sequencing performance between our proposed model, DiffuNovo, and other stateof-the-art methods on the three benchmark datasets. We report precision and AUC at the peptide level, and precision and recall at the amino acid level. The best and the second best are highlighted with bold and underline, respectively.
| Nine-species benchmark | Peptide precision | Peptide AUC | Amino acid precision | Amino acid recall |
|---|---|---|---|---|
| DeepNovo | 0.428 | 0.376 | 0.696 | 0.638 |
| PointNovo | 0.480 | 0.436 | 0.740 | 0.671 |
| Casanovo | 0.481 | 0.439 | 0.697 | 0.696 |
| AdaNovo | 0.505 | 0.469 | 0.698 | 0.709 |
| π-HelixNovo | 0.517 | 0.453 | 0.765 | 0.758 |
| DiffuNovo Logits | 0.572 | 0.413 | 0.785 | 0.783 |
| DiffuNovo MBR | 0.565 | 0.536 | 0.791 | 0.789 |
In the paper: column amino acid precision: the original table underlined π-HelixNovo (0.765).
In the paper: column peptide precision: the original table underlined π-HelixNovo (0.517).
In the paper: column amino acid recall: the original table underlined π-HelixNovo (0.758).
Table2 (HC-PT)
Regressor-guided Diffusion Model for De Novo Peptide Sequencing with Explicit Mass Control, page 7: The comparison of de novo peptide sequencing performance between our proposed model, DiffuNovo, and other stateof-the-art methods on the three benchmark datasets. We report precision and AUC at the peptide level, and precision and recall at the amino acid level. The best and the second best are highlighted with bold and underline, respectively.
|
ProteomeTools HC-PT (NovoBench) |
Peptide precision | Peptide AUC | Amino acid precision | Amino acid recall |
|---|---|---|---|---|
| DeepNovo | 0.313 | 0.255 | 0.531 | 0.534 |
| PointNovo | 0.419 | 0.373 | 0.623 | 0.622 |
| Casanovo | 0.211 | 0.177 | 0.442 | 0.453 |
| AdaNovo | 0.212 | 0.178 | 0.442 | 0.451 |
| π-HelixNovo | 0.356 | 0.318 | 0.588 | 0.582 |
| DiffuNovo Logits | 0.485 | 0.324 | 0.648 | 0.648 |
| DiffuNovo MBR | 0.458 | 0.434 | 0.654 | 0.654 |
In the paper: column amino acid precision: the original table underlined PointNovo (0.623).
In the paper: column peptide precision: the original table underlined PointNovo (0.419).
In the paper: column amino acid recall: the original table underlined PointNovo (0.622).
Table 3 (Seven-species)
Regressor-guided Diffusion Model for De Novo Peptide Sequencing with Explicit Mass Control, page 7: Empirical comparison of PTM identification. We evaluate the ability of DiffuNovo and other models to identify Post-Translational Modifications (PTMs) on the benchmark datasets. The best results and the second best are highlighted with bold and underline, respectively.
|
Seven-species benchmark NovoBench split |
Ptm precision |
|---|---|
| DeepNovo | 0.391 |
| PointNovo | 0.117 |
| AdaNovo | 0.448 |
| Casanovo | 0.360 |
| π-HelixNovo | 0.473 |
| DiffuNovo | 0.515 |
Table 3 (Nine-species)
Regressor-guided Diffusion Model for De Novo Peptide Sequencing with Explicit Mass Control, page 7: Empirical comparison of PTM identification. We evaluate the ability of DiffuNovo and other models to identify Post-Translational Modifications (PTMs) on the benchmark datasets. The best results and the second best are highlighted with bold and underline, respectively.
| Nine-species benchmark | Ptm precision |
|---|---|
| DeepNovo | 0.576 |
| PointNovo | 0.629 |
| AdaNovo | 0.652 |
| Casanovo | 0.706 |
| π-HelixNovo | 0.680 |
| DiffuNovo | 0.822 |
Table 3 (HC-PT)
Regressor-guided Diffusion Model for De Novo Peptide Sequencing with Explicit Mass Control, page 7: Empirical comparison of PTM identification. We evaluate the ability of DiffuNovo and other models to identify Post-Translational Modifications (PTMs) on the benchmark datasets. The best results and the second best are highlighted with bold and underline, respectively.
|
ProteomeTools HC-PT (NovoBench) |
Ptm precision |
|---|---|
| DeepNovo | 0.626 |
| PointNovo | 0.676 |
| AdaNovo | 0.552 |
| Casanovo | 0.501 |
| π-HelixNovo | 0.568 |
| DiffuNovo | 0.705 |
CausalNovo: Advancing De Novo Peptide Sequencing via a Causality-Informed Framework (2026) · 8 tables
Table8
CausalNovo: Advancing De Novo Peptide Sequencing via a Causality-Informed Framework, page 16: Cross-species validation on the Seven-species dataset. † denotes our retrained results.
|
Seven-species benchmark original (DeepNovo, 2017) |
Amino acid precision | Amino acid recall | ||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | Escherichia coli | Drosophila melanogaster | Homo sapiens | Mus musculus | Pseudomonas aeruginosa | Caenorhabditis elegans | Escherichia coli | Drosophila melanogaster | Homo sapiens | Mus musculus | Pseudomonas aeruginosa | |
| Casanovo | 0.436 | 0.407 | 0.435 | 0.418 | 0.496 | 0.425 | 0.439 | 0.412 | 0.438 | 0.421 | 0.496 | 0.437 |
| CausalNovo on †CasaNovo | 0.512 | 0.511 | 0.503 | 0.507 | 0.534 | 0.502 | 0.513 | 0.514 | 0.513 | 0.509 | 0.536 | 0.502 |
|
Seven-species benchmark original (DeepNovo, 2017) |
Peptide precision | Peptide AUC | ||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | Escherichia coli | Drosophila melanogaster | Homo sapiens | Mus musculus | Pseudomonas aeruginosa | Caenorhabditis elegans | Escherichia coli | Drosophila melanogaster | Homo sapiens | Mus musculus | Pseudomonas aeruginosa | |
| Casanovo | 0.220 | 0.208 | 0.222 | 0.210 | 0.268 | 0.227 | 0.174 | 0.165 | 0.179 | 0.167 | 0.223 | 0.188 |
| CausalNovo on †CasaNovo | 0.284 | 0.285 | 0.293 | 0.292 | 0.299 | 0.281 | 0.234 | 0.241 | 0.250 | 0.247 | 0.256 | 0.242 |
Table3
CausalNovo: Advancing De Novo Peptide Sequencing via a Causality-Informed Framework, page 6: Cross-species validation on the Ninespecies dataset. † denotes our retrained results.
| Nine-species benchmark | Amino acid precision | |||||||
|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | |
| Casanovo · retrained | 0.743 | 0.754 | 0.761 | 0.769 | 0.754 | 0.753 | 0.753 | 0.717 |
| CausalNovo on †CasaNovo | 0.773 | 0.772 | 0.772 | 0.780 | 0.773 | 0.784 | 0.763 | 0.748 |
| Nine-species benchmark | Amino acid recall | |||||||
|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | |
| Casanovo · retrained | 0.745 | 0.752 | 0.757 | 0.770 | 0.754 | 0.752 | 0.755 | 0.716 |
| CausalNovo on †CasaNovo | 0.774 | 0.773 | 0.774 | 0.779 | 0.776 | 0.782 | 0.763 | 0.752 |
| Nine-species benchmark | Peptide precision | |||||||
|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | |
| Casanovo · retrained | 0.559 | 0.544 | 0.554 | 0.575 | 0.558 | 0.558 | 0.549 | 0.506 |
| CausalNovo on †CasaNovo | 0.584 | 0.578 | 0.578 | 0.587 | 0.580 | 0.595 | 0.557 | 0.545 |
| Nine-species benchmark | Peptide AUC | |||||||
|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | |
| Casanovo · retrained | 0.523 | 0.509 | 0.519 | 0.540 | 0.532 | 0.521 | 0.510 | 0.464 |
| CausalNovo on †CasaNovo | 0.551 | 0.544 | 0.545 | 0.553 | 0.544 | 0.560 | 0.521 | 0.506 |
Table2 (Seven-species)
CausalNovo: Advancing De Novo Peptide Sequencing via a Causality-Informed Framework, page 6: Comparison with state-of-the-art models in PTM-level performance. † denotes our retrained results, and others are given by NovoBench. The best is marked in bold.
|
Seven-species benchmark NovoBench split |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · quoted | 0.391 | 0.373 |
| PointNovo · quoted | 0.117 | 0.094 |
| InstaNovo · quoted | 0.126 | 0.115 |
| SearchNovo · quoted | 0.472 | 0.447 |
| Casanovo · quoted | 0.360 | 0.251 |
| Casanovo · retrained | 0.368 | 0.292 |
| CausalNovo on †CasaNovo | 0.503 | 0.422 |
| AdaNovo · quoted | 0.448 | 0.321 |
| AdaNovo · retrained | 0.430 | 0.356 |
| CausalNovo on †AdaNovo | 0.469 | 0.398 |
| π-HelixNovo · quoted | 0.473 | 0.366 |
| π-HelixNovo · retrained | 0.362 | 0.370 |
| CausalNovo on †π-HelixNovo | 0.513 | 0.427 |
Table2 (Nine-species)
CausalNovo: Advancing De Novo Peptide Sequencing via a Causality-Informed Framework, page 6: Comparison with state-of-the-art models in PTM-level performance. † denotes our retrained results, and others are given by NovoBench. The best is marked in bold.
| Nine-species benchmark | Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · quoted | 0.576 | 0.529 |
| PointNovo · quoted | 0.629 | 0.546 |
| InstaNovo · quoted | 0.443 | 0.294 |
| SearchNovo · quoted | 0.764 | 0.599 |
| Casanovo · quoted | 0.706 | 0.566 |
| Casanovo · retrained | 0.755 | 0.601 |
| CausalNovo on †CasaNovo | 0.791 | 0.608 |
| AdaNovo · quoted | 0.652 | 0.570 |
| AdaNovo · retrained | 0.678 | 0.552 |
| CausalNovo on †AdaNovo | 0.769 | 0.607 |
| π-HelixNovo · quoted | 0.680 | 0.598 |
| π-HelixNovo · retrained | 0.723 | 0.593 |
| CausalNovo on †π-HelixNovo | 0.731 | 0.616 |
Table2 (HC-PT)
CausalNovo: Advancing De Novo Peptide Sequencing via a Causality-Informed Framework, page 6: Comparison with state-of-the-art models in PTM-level performance. † denotes our retrained results, and others are given by NovoBench. The best is marked in bold.
|
ProteomeTools HC-PT (NovoBench) |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · quoted | 0.626 | 0.615 |
| PointNovo · quoted | 0.676 | 0.740 |
| InstaNovo · quoted | 0.350 | 0.261 |
| SearchNovo · quoted | 0.715 | 0.772 |
| Casanovo · quoted | 0.501 | 0.460 |
| Casanovo · retrained | 0.550 | 0.582 |
| CausalNovo on †CasaNovo | 0.671 | 0.741 |
| AdaNovo · quoted | 0.552 | 0.482 |
| AdaNovo · retrained | 0.562 | 0.532 |
| CausalNovo on †AdaNovo | 0.652 | 0.743 |
| π-HelixNovo · quoted | 0.568 | 0.667 |
| π-HelixNovo · retrained | 0.632 | 0.566 |
| CausalNovo on †π-HelixNovo | 0.737 | 0.746 |
Table1 (Seven-species)
CausalNovo: Advancing De Novo Peptide Sequencing via a Causality-Informed Framework, page 6: Comparison with state-of-the-art models in amino acid-level and peptide-level performance. † denotes our retrained results, and others are provided by NovoBench. The best results are marked in bold, and the second-best results are underlined.
|
Seven-species benchmark NovoBench split |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| DeepNovo · quoted | 0.492 | 0.433 | 0.204 | 0.136 |
| PointNovo · quoted | 0.196 | 0.169 | 0.022 | 0.007 |
| InstaNovo · quoted | 0.192 | 0.176 | 0.031 | 0.009 |
| SearchNovo · quoted | 0.489 | 0.488 | 0.259 | 0.174 |
| Casanovo · quoted | 0.322 | 0.327 | 0.119 | 0.084 |
| Casanovo · retrained | 0.357 | 0.366 | 0.159 | 0.119 |
| CausalNovo on †CasaNovo | 0.477 | 0.478 | 0.245 | 0.200 |
| AdaNovo · quoted | 0.379 | 0.385 | 0.174 | 0.135 |
| AdaNovo · retrained | 0.403 | 0.405 | 0.189 | 0.149 |
| CausalNovo on †AdaNovo | 0.453 | 0.453 | 0.233 | 0.192 |
| π-HelixNovo · quoted | 0.481 | 0.472 | 0.234 | 0.173 |
| π-HelixNovo · retrained | 0.465 | 0.462 | 0.218 | 0.156 |
| CausalNovo on †π-HelixNovo | 0.536 | 0.534 | 0.282 | 0.229 |
Table1 (Nine-species)
CausalNovo: Advancing De Novo Peptide Sequencing via a Causality-Informed Framework, page 6: Comparison with state-of-the-art models in amino acid-level and peptide-level performance. † denotes our retrained results, and others are provided by NovoBench. The best results are marked in bold, and the second-best results are underlined.
| Nine-species benchmark | Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| PEAKS · quoted | 0.748 | 0.428 | ||
| DeepNovo · quoted | 0.696 | 0.638 | 0.428 | 0.376 |
| PointNovo · quoted | 0.740 | 0.671 | 0.480 | 0.436 |
| InstaNovo · quoted | 0.420 | 0.395 | 0.164 | 0.123 |
| SearchNovo · quoted | 0.748 | 0.746 | 0.550 | 0.489 |
| Casanovo · quoted | 0.697 | 0.696 | 0.481 | 0.439 |
| Casanovo · retrained | 0.741 | 0.740 | 0.529 | 0.493 |
| CausalNovo on †CasaNovo | 0.765 | 0.766 | 0.564 | 0.528 |
| AdaNovo · quoted | 0.698 | 0.709 | 0.505 | 0.469 |
| AdaNovo · retrained | 0.681 | 0.681 | 0.473 | 0.439 |
| CausalNovo on †AdaNovo | 0.744 | 0.746 | 0.542 | 0.507 |
| π-HelixNovo · quoted | 0.765 | 0.758 | 0.517 | 0.453 |
| π-HelixNovo · retrained | 0.765 | 0.752 | 0.509 | 0.431 |
| CausalNovo on †π-HelixNovo | 0.787 | 0.784 | 0.543 | 0.483 |
Table1 (HC-PT)
CausalNovo: Advancing De Novo Peptide Sequencing via a Causality-Informed Framework, page 6: Comparison with state-of-the-art models in amino acid-level and peptide-level performance. † denotes our retrained results, and others are provided by NovoBench. The best results are marked in bold, and the second-best results are underlined.
|
ProteomeTools HC-PT (NovoBench) |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| DeepNovo · quoted | 0.531 | 0.534 | 0.313 | 0.255 |
| PointNovo · quoted | 0.623 | 0.622 | 0.419 | 0.373 |
| InstaNovo · quoted | 0.289 | 0.285 | 0.057 | 0.034 |
| SearchNovo · quoted | 0.652 | 0.658 | 0.447 | 0.413 |
| Casanovo · quoted | 0.442 | 0.453 | 0.211 | 0.177 |
| Casanovo · retrained | 0.525 | 0.530 | 0.324 | 0.290 |
| CausalNovo on †CasaNovo | 0.635 | 0.639 | 0.459 | 0.426 |
| AdaNovo · quoted | 0.442 | 0.451 | 0.212 | 0.178 |
| AdaNovo · retrained | 0.492 | 0.496 | 0.289 | 0.254 |
| CausalNovo on †AdaNovo | 0.634 | 0.637 | 0.453 | 0.420 |
| π-HelixNovo · quoted | 0.588 | 0.582 | 0.356 | 0.318 |
| π-HelixNovo · retrained | 0.532 | 0.537 | 0.301 | 0.261 |
| CausalNovo on †π-HelixNovo | 0.656 | 0.658 | 0.450 | 0.415 |
Bidirectional Representations Augmented Autoregressive Biological Sequence Generation (2025) · 4 tables
Table7
Bidirectional Representations Augmented Autoregressive Biological Sequence Generation, page 26: Comparison of the performance of CROSSNOVO and baseline methods on IgG1-Human. Bold values indicate the best performance.
The same table is also printed in Bidirectional Representations Augmented Autoregressive Biological Sequence Generation (Table7, page 26).
|
Monoclonal antibody de novo assembly as deposited |
Amino acid precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| HC AspN | HC Chymotrypsin | HC GluC | HC LysC | HC Proteinase K | HC Trypsin | LC AspN | LC LysC | Average | |
| Casanovo V2 | 0.520 | 0.472 | 0.605 | 0.757 | 0.354 | 0.759 | 0.666 | 0.778 | 0.642 |
| ContraNovo | 0.580 | 0.565 | 0.642 | 0.790 | 0.348 | 0.787 | 0.702 | 0.793 | 0.676 |
| CrossNovo | 0.613 | 0.617 | 0.694 | 0.814 | 0.367 | 0.803 | 0.719 | 0.807 | 0.702 |
|
Monoclonal antibody de novo assembly as deposited |
Peptide recall | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| HC AspN | HC Chymotrypsin | HC GluC | HC LysC | HC Proteinase K | HC Trypsin | LC AspN | LC LysC | Average | |
| Casanovo V2 | 0.265 | 0.274 | 0.399 | 0.569 | 0.206 | 0.595 | 0.325 | 0.625 | 0.446 |
| ContraNovo | 0.396 | 0.372 | 0.437 | 0.653 | 0.274 | 0.675 | 0.499 | 0.646 | 0.529 |
| CrossNovo | 0.415 | 0.421 | 0.512 | 0.701 | 0.275 | 0.699 | 0.544 | 0.676 | 0.560 |
Table6
Bidirectional Representations Augmented Autoregressive Biological Sequence Generation, page 26: Comparison of the performance of CROSSNOVO and baseline methods on WIgG1-Mouse. The bold font indicates the best performance.
The same table is also printed in Bidirectional Representations Augmented Autoregressive Biological Sequence Generation (Table6, page 26).
|
Monoclonal antibody de novo assembly as deposited |
Amino acid precision | Peptide recall | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| HC AspN | HC Chymotrypsin | HC Trypsin | LC AspN | Average | HC AspN | HC Chymotrypsin | HC Trypsin | LC AspN | Average | |
| Casanovo V2 | 0.714 | 0.591 | 0.723 | 0.668 | 0.674 | 0.557 | 0.483 | 0.636 | 0.456 | 0.533 |
| ContraNovo | 0.750 | 0.612 | 0.650 | 0.649 | 0.665 | 0.649 | 0.545 | 0.671 | 0.519 | 0.596 |
| CrossNovo | 0.769 | 0.640 | 0.747 | 0.724 | 0.720 | 0.662 | 0.577 | 0.699 | 0.581 | 0.630 |
Table2
Bidirectional Representations Augmented Autoregressive Biological Sequence Generation, page 8: Comparison of the performance of CROSSNOVO and baseline methods on 9-species-v2 test set. The bold font indicates the best performance.
The same table is also printed in Bidirectional Representations Augmented Autoregressive Biological Sequence Generation (Table2, page 8), Distilling Non-Autoregressive Model Knowledge for Autoregressive De Novo Peptide Sequencing (Table2, page 8).
|
Nine-species benchmark revised (build not stated) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| π-PrimeNovo | 0.839 | 0.893 | 0.932 | 0.908 | 0.862 | 0.909 | 0.931 | 0.921 | 0.827 | 0.891 |
| Casanovo V2 | 0.813 | 0.872 | 0.915 | 0.877 | 0.823 | 0.891 | 0.891 | 0.888 | 0.791 | 0.862 |
| ContraNovo | 0.839 | 0.920 | 0.919 | 0.896 | 0.848 | 0.898 | 0.913 | 0.901 | 0.807 | 0.882 |
| CrossNovo | 0.857 | 0.937 | 0.939 | 0.920 | 0.880 | 0.914 | 0.939 | 0.927 | 0.837 | 0.906 |
|
Nine-species benchmark revised (build not stated) |
Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| π-PrimeNovo | 0.627 | 0.795 | 0.884 | 0.812 | 0.742 | 0.824 | 0.837 | 0.849 | 0.626 | 0.777 |
| Casanovo V2 | 0.555 | 0.712 | 0.837 | 0.754 | 0.669 | 0.783 | 0.772 | 0.793 | 0.558 | 0.714 |
| ContraNovo | 0.616 | 0.820 | 0.854 | 0.780 | 0.711 | 0.794 | 0.799 | 0.815 | 0.575 | 0.752 |
| CrossNovo | 0.651 | 0.850 | 0.885 | 0.819 | 0.751 | 0.816 | 0.847 | 0.850 | 0.607 | 0.786 |
Table1
Bidirectional Representations Augmented Autoregressive Biological Sequence Generation, page 8: Comparison of the performance of CROSSNOVO and baseline methods on the 9-species-v1 test set.
The same table is also printed in Bidirectional Representations Augmented Autoregressive Biological Sequence Generation (Table1, page 8).
|
Nine-species benchmark original (DeepNovo, 2017) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| PEAKS | 0.600 | 0.639 | 0.748 | 0.673 | 0.633 | 0.728 | 0.644 | 0.719 | 0.586 | 0.663 |
| π-PrimeNovo | 0.784 | 0.729 | 0.802 | 0.801 | 0.763 | 0.815 | 0.822 | 0.846 | 0.734 | 0.788 |
| DeepNovo | 0.623 | 0.610 | 0.750 | 0.694 | 0.630 | 0.731 | 0.679 | 0.742 | 0.602 | 0.673 |
| PointNovo | 0.626 | 0.606 | 0.779 | 0.712 | 0.644 | 0.733 | 0.730 | 0.768 | 0.589 | 0.687 |
| Casanovo | 0.689 | 0.586 | 0.684 | 0.679 | 0.629 | 0.721 | 0.668 | 0.749 | 0.603 | 0.667 |
| InstaNovo | 0.703 | 0.636 | 0.691 | 0.712 | 0.660 | 0.732 | 0.711 | 0.739 | 0.619 | 0.689 |
| Casanovo V2 | 0.760 | 0.676 | 0.752 | 0.755 | 0.706 | 0.785 | 0.748 | 0.790 | 0.681 | 0.739 |
| π-HelixNovo | 0.765 | 0.665 | 0.768 | 0.784 | 0.757 | 0.721 | 0.793 | 0.816 | 0.681 | 0.750 |
| ContraNovo | 0.798 | 0.771 | 0.797 | 0.799 | 0.745 | 0.810 | 0.807 | 0.828 | 0.711 | 0.785 |
| CrossNovo | 0.816 | 0.800 | 0.814 | 0.826 | 0.785 | 0.830 | 0.831 | 0.856 | 0.740 | 0.811 |
|
Nine-species benchmark original (DeepNovo, 2017) |
Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| PEAKS | 0.197 | 0.277 | 0.428 | 0.356 | 0.287 | 0.403 | 0.362 | 0.387 | 0.203 | 0.322 |
| π-PrimeNovo | 0.567 | 0.574 | 0.697 | 0.650 | 0.603 | 0.697 | 0.702 | 0.721 | 0.531 | 0.638 |
| DeepNovo | 0.286 | 0.293 | 0.462 | 0.422 | 0.330 | 0.454 | 0.436 | 0.449 | 0.253 | 0.376 |
| PointNovo | 0.355 | 0.351 | 0.534 | 0.478 | 0.396 | 0.513 | 0.511 | 0.518 | 0.298 | 0.439 |
| Casanovo | 0.426 | 0.341 | 0.490 | 0.478 | 0.406 | 0.521 | 0.506 | 0.537 | 0.330 | 0.448 |
| InstaNovo | 0.471 | 0.455 | 0.559 | 0.528 | 0.466 | 0.732 | 0.564 | 0.576 | 0.416 | 0.530 |
| Casanovo V2 | 0.483 | 0.446 | 0.599 | 0.557 | 0.493 | 0.618 | 0.589 | 0.622 | 0.446 | 0.539 |
| π-HelixNovo | 0.483 | 0.392 | 0.568 | 0.560 | 0.473 | 0.560 | 0.623 | 0.596 | 0.388 | 0.517 |
| ContraNovo | 0.567 | 0.622 | 0.674 | 0.630 | 0.576 | 0.672 | 0.677 | 0.688 | 0.486 | 0.621 |
| CrossNovo | 0.596 | 0.661 | 0.698 | 0.660 | 0.610 | 0.695 | 0.716 | 0.726 | 0.518 | 0.654 |
In the paper: column peptide recall, Mouse: the original table only underlined ContraNovo (Contra.) (0.567); π-PrimeNovo (Prime.) (0.567) ties with it and is underlined here too.
In the paper: column peptide recall, Tomato: the original table bolded π-PrimeNovo (Prime.) (0.697), InstaNovo (Insta) (0.732) and underlined CrossNovo (Ours) (0.695).
RT-GCTnovo: A Peptide De Novo Sequencing Model Incorporating Gated Multi-scale Features and Dynamic Mass Masks (2025) · 1 table
TABLE I
RT-GCTnovo: A Peptide De Novo Sequencing Model Incorporating Gated Multi-scale Features and Dynamic Mass Masks, page 6: Comparison of Average Accuracy (%)
| Nine-species benchmark | Peptide accuracy | Amino acid accuracy |
|---|---|---|
| DeepNovo | 0.376 | 0.673 |
| Casanovo | 0.449 | 0.678 |
| TSARseqNovo | 0.546 | 0.775 |
| RT-GCTnovo | 0.577 | 0.798 |
Protein Language Model-Aligned Spectra Embeddings for De Novo Peptide Sequencing (2025) · 2 tables
Table 2
Protein Language Model-Aligned Spectra Embeddings for De Novo Peptide Sequencing, page 7: Performance comparison results in terms of amino acid precision and peptide recall on the ninespecies dataset [55]. The performance of the baseline methods, except for Casanovo v4.2, is reported from [65]. Bolded and underlined results represent the first and second best performance per species (or averaged across species in the last column), respectively.
| Nine-species benchmark | Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| DeepNovo | 0.742 | 0.602 | 0.630 | 0.610 | 0.694 | 0.623 | 0.679 | 0.731 | 0.750 | 0.673 |
| PointNovo | 0.768 | 0.589 | 0.644 | 0.606 | 0.712 | 0.626 | 0.730 | 0.733 | 0.779 | 0.687 |
| Casanovo · retrained | 0.749 | 0.603 | 0.629 | 0.586 | 0.679 | 0.689 | 0.668 | 0.721 | 0.684 | 0.667 |
| AdaNovo | 0.739 | 0.642 | 0.650 | 0.618 | 0.728 | 0.646 | 0.719 | 0.740 | 0.793 | 0.697 |
| Casanovo V2 · retrained | 0.790 | 0.681 | 0.706 | 0.676 | 0.755 | 0.760 | 0.748 | 0.785 | 0.752 | 0.739 |
| Casanovo v4.2 · retrained | 0.793 | 0.678 | 0.705 | 0.668 | 0.687 | 0.756 | 0.753 | 0.791 | 0.768 | 0.733 |
| PLMNovo ESM-2 8M | 0.794 | 0.684 | 0.707 | 0.670 | 0.755 | 0.759 | 0.764 | 0.790 | 0.755 | 0.742 |
| PLMNovo ESM-2 650M | 0.797 | 0.688 | 0.709 | 0.676 | 0.755 | 0.760 | 0.766 | 0.795 | 0.771 | 0.746 |
| Nine-species benchmark | Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| DeepNovo | 0.449 | 0.253 | 0.330 | 0.293 | 0.422 | 0.286 | 0.436 | 0.454 | 0.462 | 0.376 |
| PointNovo | 0.518 | 0.298 | 0.396 | 0.351 | 0.478 | 0.355 | 0.511 | 0.513 | 0.534 | 0.439 |
| Casanovo · retrained | 0.537 | 0.330 | 0.406 | 0.341 | 0.478 | 0.426 | 0.506 | 0.521 | 0.490 | 0.448 |
| AdaNovo | 0.528 | 0.372 | 0.431 | 0.373 | 0.496 | 0.467 | 0.546 | 0.530 | 0.593 | 0.481 |
| Casanovo V2 · retrained | 0.622 | 0.446 | 0.493 | 0.446 | 0.557 | 0.483 | 0.589 | 0.618 | 0.599 | 0.539 |
| Casanovo v4.2 · retrained | 0.603 | 0.421 | 0.478 | 0.437 | 0.498 | 0.468 | 0.558 | 0.608 | 0.584 | 0.517 |
| PLMNovo ESM-2 8M | 0.602 | 0.423 | 0.484 | 0.434 | 0.544 | 0.470 | 0.565 | 0.606 | 0.571 | 0.522 |
| PLMNovo ESM-2 650M | 0.601 | 0.425 | 0.483 | 0.432 | 0.544 | 0.464 | 0.576 | 0.606 | 0.579 | 0.523 |
Table 1
Protein Language Model-Aligned Spectra Embeddings for De Novo Peptide Sequencing, page 6: Amino acid-level and peptide-level performance comparison on the MSKB and multi-enzyme test sets [32]. Numbers in bold represent the best result under each (metric, dataset) combination.
| a dataset per row group | Amino acid precision | Amino acid recall | Peptide precision | |||
|---|---|---|---|---|---|---|
| MSKB (tryptic) | Multi-enzyme (non-tryptic) | MSKB (tryptic) | Multi-enzyme (non-tryptic) | MSKB (tryptic) | Multi-enzyme (non-tryptic) | |
| Casanovo v4.2 · retrained | 0.8919 | 0.5200 | 0.8884 | 0.5211 | 0.7381 | 0.2467 |
| PLMNovo ESM-2 8M | 0.8973 | 0.5249 | 0.8921 | 0.5283 | 0.7411 | 0.2410 |
| PLMNovo ESM-2 650M | 0.8976 | 0.5356 | 0.8915 | 0.5323 | 0.7400 | 0.2483 |
MSKB is MassIVE-KB, under the train/test split (200,000 tryptic test spectra) published with Melendez et al.'s enzyme-bias data on Zenodo 12587317, the paper's reference [32]; that split mixes MassIVE-KB v1 and v2.0.15, so no version is recorded. The multi-enzyme rows are the held-out non-tryptic set from the same deposit.
Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing (2025) · 8 tables
Table7
Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing, page 8: Parameters vs. model performance. ¶ is the extension.
The same table is also printed in Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing (Table7, page 8).
| Nine-species benchmark | Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| Average | Average | Average | Average | |
| Casanovo · retrained | 0.741 | 0.740 | 0.529 | 0.493 |
| Casanovo extended to 12 layers + FFN · retrained | 0.750 | 0.751 | 0.539 | 0.494 |
| LIPNovo | 0.797 | 0.797 | 0.582 | 0.547 |
Every number is the nine-species average: the Baseline and LIPNovo rows repeat Table 1's Average column exactly. Baseline is LIPNovo's own retrained Casanovo; Baseline¶ is that model widened to 12 layers plus an FFN to match LIPNovo's size. The '# Params' column (47.4M, 69.4M, 68.4M) is read into the row labels and is not recorded as a measurement.
Table3
Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing, page 7: Leave-one-out cross validation compared to baseline on the Nine-species dataset. † means our re-trained results.
The same table is also printed in Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing (Table3, page 7).
| Nine-species benchmark | Amino acid precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo · retrained | 0.743 | 0.754 | 0.761 | 0.769 | 0.754 | 0.753 | 0.753 | 0.717 | 0.751 |
| LIPNovo | 0.806 | 0.805 | 0.807 | 0.805 | 0.807 | 0.808 | 0.794 | 0.800 | 0.804 |
| Nine-species benchmark | Amino acid recall | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo · retrained | 0.745 | 0.752 | 0.757 | 0.770 | 0.754 | 0.752 | 0.755 | 0.716 | 0.750 |
| LIPNovo | 0.807 | 0.805 | 0.806 | 0.805 | 0.807 | 0.807 | 0.796 | 0.798 | 0.804 |
| Nine-species benchmark | Peptide precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo · retrained | 0.559 | 0.544 | 0.554 | 0.575 | 0.558 | 0.558 | 0.549 | 0.506 | 0.550 |
| LIPNovo | 0.607 | 0.591 | 0.606 | 0.596 | 0.596 | 0.607 | 0.577 | 0.577 | 0.595 |
| Nine-species benchmark | Peptide AUC | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo · retrained | 0.523 | 0.509 | 0.519 | 0.540 | 0.532 | 0.521 | 0.510 | 0.464 | 0.515 |
| LIPNovo | 0.581 | 0.563 | 0.577 | 0.567 | 0.565 | 0.579 | 0.545 | 0.544 | 0.565 |
| Nine-species benchmark | Ptm precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo · retrained | 0.797 | 0.742 | 0.762 | 0.784 | 0.779 | 0.799 | 0.760 | 0.710 | 0.767 |
| LIPNovo | 0.855 | 0.764 | 0.769 | 0.772 | 0.812 | 0.803 | 0.764 | 0.777 | 0.790 |
| Nine-species benchmark | Ptm recall | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Mean | |
| Casanovo · retrained | 0.689 | 0.591 | 0.624 | 0.612 | 0.582 | 0.608 | 0.593 | 0.540 | 0.605 |
| LIPNovo | 0.739 | 0.647 | 0.675 | 0.672 | 0.630 | 0.667 | 0.634 | 0.627 | 0.661 |
Table2 (Seven-species)
Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing, page 6: Empirical comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in PTM-level performance. † denotes our retrained results, and other results are given by NovoBench. The best results are marked in bold.
The same table is also printed in Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing (Table2, page 6).
|
Seven-species benchmark NovoBench split |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · quoted | 0.391 | 0.373 |
| PointNovo · quoted | 0.117 | 0.094 |
| InstaNovo · quoted | 0.126 | 0.115 |
| Casanovo · quoted | 0.360 | 0.251 |
| AdaNovo · quoted | 0.448 | 0.321 |
| AdaNovo · retrained | 0.430 | 0.356 |
| π-HelixNovo · quoted | 0.473 | 0.366 |
| π-HelixNovo · retrained | 0.362 | 0.370 |
| Casanovo · retrained | 0.368 | 0.292 |
| LIPNovo | 0.604 | 0.498 |
Table2 (Nine-species)
Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing, page 6: Empirical comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in PTM-level performance. † denotes our retrained results, and other results are given by NovoBench. The best results are marked in bold.
The same table is also printed in Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing (Table2, page 6).
| Nine-species benchmark | Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · quoted | 0.576 | 0.529 |
| PointNovo · quoted | 0.629 | 0.546 |
| InstaNovo · quoted | 0.443 | 0.294 |
| Casanovo · quoted | 0.706 | 0.566 |
| AdaNovo · quoted | 0.652 | 0.570 |
| AdaNovo · retrained | 0.678 | 0.552 |
| π-HelixNovo · quoted | 0.680 | 0.598 |
| π-HelixNovo · retrained | 0.723 | 0.593 |
| Casanovo · retrained | 0.755 | 0.601 |
| LIPNovo | 0.765 | 0.656 |
Table2 (HC-PT)
Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing, page 6: Empirical comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in PTM-level performance. † denotes our retrained results, and other results are given by NovoBench. The best results are marked in bold.
The same table is also printed in Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing (Table2, page 6).
|
ProteomeTools HC-PT (NovoBench) |
Ptm precision | Ptm recall |
|---|---|---|
| DeepNovo · quoted | 0.626 | 0.615 |
| PointNovo · quoted | 0.676 | 0.740 |
| InstaNovo · quoted | 0.350 | 0.261 |
| Casanovo · quoted | 0.501 | 0.460 |
| AdaNovo · quoted | 0.552 | 0.482 |
| AdaNovo · retrained | 0.562 | 0.532 |
| π-HelixNovo · quoted | 0.568 | 0.667 |
| π-HelixNovo · retrained | 0.632 | 0.566 |
| Casanovo · retrained | 0.550 | 0.582 |
| LIPNovo | 0.732 | 0.745 |
Table1 (Seven-species)
Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing, page 6: Empirical comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in amino acid-level and peptide-level performance. † denotes our retrained results, and other results are provided by NovoBench. The best is marked in bold.
The same table is also printed in Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing (Table1, page 6).
|
Seven-species benchmark NovoBench split |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| DeepNovo · quoted | 0.492 | 0.433 | 0.204 | 0.136 |
| PointNovo · quoted | 0.196 | 0.169 | 0.022 | 0.007 |
| InstaNovo · quoted | 0.192 | 0.176 | 0.031 | 0.009 |
| Casanovo · quoted | 0.322 | 0.327 | 0.119 | 0.084 |
| AdaNovo · quoted | 0.379 | 0.385 | 0.174 | 0.135 |
| AdaNovo · retrained | 0.403 | 0.405 | 0.189 | 0.149 |
| π-HelixNovo · quoted | 0.481 | 0.472 | 0.234 | 0.173 |
| π-HelixNovo · retrained | 0.465 | 0.462 | 0.218 | 0.156 |
| Casanovo · retrained | 0.357 | 0.366 | 0.159 | 0.119 |
| LIPNovo | 0.557 | 0.560 | 0.327 | 0.281 |
Table1 (Nine-species)
Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing, page 6: Empirical comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in amino acid-level and peptide-level performance. † denotes our retrained results, and other results are provided by NovoBench. The best is marked in bold.
The same table is also printed in Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing (Table1, page 6).
| Nine-species benchmark | Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| PEAKS · quoted | 0.748 | 0.428 | ||
| DeepNovo · quoted | 0.696 | 0.638 | 0.428 | 0.376 |
| PointNovo · quoted | 0.740 | 0.671 | 0.480 | 0.436 |
| InstaNovo · quoted | 0.420 | 0.395 | 0.164 | 0.123 |
| Casanovo · quoted | 0.697 | 0.696 | 0.481 | 0.439 |
| AdaNovo · quoted | 0.698 | 0.709 | 0.505 | 0.469 |
| AdaNovo · retrained | 0.681 | 0.681 | 0.473 | 0.439 |
| π-HelixNovo · quoted | 0.765 | 0.758 | 0.517 | 0.453 |
| π-HelixNovo · retrained | 0.765 | 0.752 | 0.509 | 0.431 |
| Casanovo · retrained | 0.741 | 0.740 | 0.529 | 0.493 |
| LIPNovo | 0.797 | 0.797 | 0.582 | 0.547 |
In the paper: column amino acid precision: the original table only underlined π-HelixNovo (π-HelixNovo† (Yang et al., 2024)) (0.765); π-HelixNovo (π-HelixNovo (Yang et al., 2024)) (0.765) ties with it and is underlined here too.
Table1 (HC-PT)
Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing, page 6: Empirical comparison with state-of-the-art methods on Nine-species, Seven-species, and HC-PT datasets in amino acid-level and peptide-level performance. † denotes our retrained results, and other results are provided by NovoBench. The best is marked in bold.
The same table is also printed in Latent Imputation before Prediction: A New Computational Paradigm for De Novo Peptide Sequencing (Table1, page 6).
|
ProteomeTools HC-PT (NovoBench) |
Amino acid precision | Amino acid recall | Peptide precision | Peptide AUC |
|---|---|---|---|---|
| DeepNovo · quoted | 0.531 | 0.534 | 0.313 | 0.255 |
| PointNovo · quoted | 0.623 | 0.622 | 0.419 | 0.373 |
| InstaNovo · quoted | 0.289 | 0.285 | 0.057 | 0.034 |
| Casanovo · quoted | 0.442 | 0.453 | 0.211 | 0.177 |
| AdaNovo · quoted | 0.442 | 0.451 | 0.212 | 0.178 |
| AdaNovo · retrained | 0.492 | 0.496 | 0.289 | 0.254 |
| π-HelixNovo · quoted | 0.588 | 0.582 | 0.356 | 0.318 |
| π-HelixNovo · retrained | 0.532 | 0.537 | 0.301 | 0.261 |
| Casanovo · retrained | 0.525 | 0.530 | 0.324 | 0.290 |
| LIPNovo | 0.637 | 0.643 | 0.458 | 0.427 |
Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing (2025) · 5 tables
Table6 (Seven-species)
Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing, page 18: Performance comparison on the NovoBench benchmark (yeast test species). Scores for models marked with * are quoted from the NovoBench paper or original publications. CV denotes cross-validation results from the original PrimeNovo paper. “–” indicates data not available.
The same table is also printed in Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing (Table6, page 18).
|
Seven-species benchmark NovoBench split |
Peptide precision |
|---|---|
| Casanovo · quoted | 0.12 |
| AdaNovo · quoted | 0.17 |
| π-HelixNovo · quoted | 0.23 |
| SearchNovo · quoted | 0.26 |
| Casanovo pretrained · released | 0.05 |
| π-PrimeNovo | 0.09 |
| RefineNovo | 0.09 |
In the paper: column peptide precision, yeast: the original table bolded RefineNovo (0.09).
Table6 (Nine-species)
Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing, page 18: Performance comparison on the NovoBench benchmark (yeast test species). Scores for models marked with * are quoted from the NovoBench paper or original publications. CV denotes cross-validation results from the original PrimeNovo paper. “–” indicates data not available.
The same table is also printed in Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing (Table6, page 18).
| Nine-species benchmark | Peptide precision |
|---|---|
| Saccharomyces cerevisiae | |
| Casanovo · quoted | 0.48 |
| InstaNovo · quoted | 0.53 |
| AdaNovo · quoted | 0.50 |
| π-HelixNovo · quoted | 0.52 |
| SearchNovo · quoted | 0.55 |
| π-PrimeNovo CV · quoted | 0.58 |
| Casanovo pretrained · released | 0.60 |
| π-PrimeNovo | 0.70 |
| RefineNovo | 0.71 |
Table6 (HC-PT)
Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing, page 18: Performance comparison on the NovoBench benchmark (yeast test species). Scores for models marked with * are quoted from the NovoBench paper or original publications. CV denotes cross-validation results from the original PrimeNovo paper. “–” indicates data not available.
The same table is also printed in Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing (Table6, page 18).
|
ProteomeTools HC-PT (NovoBench) |
Peptide precision |
|---|---|
| Casanovo · quoted | 0.21 |
| InstaNovo · quoted | 0.57 |
| AdaNovo · quoted | 0.21 |
| π-HelixNovo · quoted | 0.21 |
| SearchNovo · quoted | 0.45 |
| π-PrimeNovo | 0.85 |
| RefineNovo | 0.88 |
Table2
Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing, page 9: Comparison of the performance on the 9-species-V2 benchmark datasets. AT stands for Autoregressive Transformer and NAT stands for non-autoregressive Transformer.
The same table is also printed in Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing (Table2, page 9).
|
Nine-species benchmark revised (build not stated) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| Casanovo V2 · released | 0.813 | 0.872 | 0.915 | 0.877 | 0.823 | 0.891 | 0.891 | 0.888 | 0.791 | 0.862 |
| π-PrimeNovo · released | 0.839 | 0.893 | 0.932 | 0.908 | 0.862 | 0.909 | 0.931 | 0.921 | 0.827 | 0.891 |
| RefineNovo | 0.850 | 0.921 | 0.941 | 0.921 | 0.879 | 0.916 | 0.931 | 0.942 | 0.841 | 0.907 |
|
Nine-species benchmark revised (build not stated) |
Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| Casanovo V2 · released | 0.555 | 0.712 | 0.837 | 0.754 | 0.669 | 0.783 | 0.772 | 0.793 | 0.558 | 0.714 |
| π-PrimeNovo · released | 0.627 | 0.795 | 0.884 | 0.812 | 0.742 | 0.824 | 0.837 | 0.849 | 0.626 | 0.777 |
| RefineNovo | 0.637 | 0.805 | 0.895 | 0.827 | 0.762 | 0.829 | 0.862 | 0.856 | 0.637 | 0.790 |
In the paper: column amino acid precision, Ricebean: the original table only bolded RefineNovo (Ours) (0.931); π-PrimeNovo (Prime. (Zhang et al., 2025)) (0.931) ties with it and is bolded here too.
Table1
Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing, page 7: Comparison of the performance on the 9-species-V1 benchmark datasets. The models are categorized by their architecture type: DB represents Database, AR stands for Autoregressive Generation, and NAR denotes Non-Autoregressive Generation. The bold font indicates the best performance.
The same table is also printed in Curriculum Learning for Biological Sequence Prediction: The Case of De Novo Peptide Sequencing (Table1, page 7).
|
Nine-species benchmark original (DeepNovo, 2017) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| PEAKS | 0.600 | 0.639 | 0.748 | 0.673 | 0.633 | 0.728 | 0.644 | 0.719 | 0.586 | 0.663 |
| DeepNovo | 0.623 | 0.610 | 0.750 | 0.694 | 0.630 | 0.731 | 0.679 | 0.742 | 0.602 | 0.673 |
| PointNovo | 0.626 | 0.606 | 0.779 | 0.712 | 0.644 | 0.733 | 0.730 | 0.768 | 0.589 | 0.687 |
| Casanovo · released | 0.689 | 0.586 | 0.684 | 0.679 | 0.629 | 0.721 | 0.668 | 0.749 | 0.603 | 0.667 |
| AdaNovo | 0.646 | 0.618 | 0.793 | 0.728 | 0.650 | 0.740 | 0.719 | 0.739 | 0.642 | 0.697 |
| Casanovo V2 · released | 0.760 | 0.676 | 0.752 | 0.755 | 0.706 | 0.785 | 0.748 | 0.790 | 0.681 | 0.739 |
| π-PrimeNovo · released | 0.784 | 0.729 | 0.802 | 0.801 | 0.763 | 0.815 | 0.822 | 0.846 | 0.734 | 0.788 |
| RefineNovo | 0.800 | 0.730 | 0.818 | 0.819 | 0.780 | 0.825 | 0.835 | 0.854 | 0.742 | 0.800 |
|
Nine-species benchmark original (DeepNovo, 2017) |
Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| PEAKS | 0.197 | 0.277 | 0.428 | 0.356 | 0.287 | 0.403 | 0.362 | 0.387 | 0.203 | 0.322 |
| DeepNovo | 0.286 | 0.293 | 0.462 | 0.422 | 0.330 | 0.454 | 0.436 | 0.449 | 0.253 | 0.376 |
| PointNovo | 0.355 | 0.351 | 0.534 | 0.478 | 0.396 | 0.513 | 0.511 | 0.518 | 0.298 | 0.439 |
| Casanovo · released | 0.426 | 0.341 | 0.490 | 0.478 | 0.406 | 0.521 | 0.506 | 0.537 | 0.330 | 0.448 |
| AdaNovo | 0.467 | 0.373 | 0.593 | 0.496 | 0.431 | 0.530 | 0.546 | 0.528 | 0.372 | 0.481 |
| Casanovo V2 · released | 0.483 | 0.446 | 0.599 | 0.557 | 0.493 | 0.618 | 0.589 | 0.622 | 0.446 | 0.539 |
| π-PrimeNovo · released | 0.567 | 0.574 | 0.697 | 0.650 | 0.603 | 0.697 | 0.702 | 0.721 | 0.531 | 0.638 |
| RefineNovo | 0.583 | 0.581 | 0.709 | 0.667 | 0.616 | 0.705 | 0.720 | 0.736 | 0.549 | 0.653 |
Universal Biological Sequence Reranking for Improved De Novo Peptide Sequencing (2025) · 3 tables
Table7
Universal Biological Sequence Reranking for Improved De Novo Peptide Sequencing, page 17: Evaluation of RankNovo in comparison to baseline and base methods on the 9-species-V2 test set. Bolded entries indicate the best-performing models. The symbol “†” indicates that the model serves as both a baseline and a base model. “⋆” signifies that the base models were developed and trained by us.
The same table is also printed in RankNovo: A Universal Reranking Approach for Robust De Novo Peptide Sequencing (Table2, page 8).
|
Nine-species benchmark revised (build not stated) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| Casanovo V2 · released | 0.888 | 0.791 | 0.823 | 0.872 | 0.877 | 0.813 | 0.891 | 0.891 | 0.915 | 0.862 |
| ContraNovo · released | 0.901 | 0.807 | 0.848 | 0.920 | 0.896 | 0.839 | 0.913 | 0.898 | 0.919 | 0.882 |
| ByNovo | 0.92 | 0.823 | 0.876 | 0.917 | 0.914 | 0.841 | 0.932 | 0.912 | 0.934 | 0.897 |
| Casanovo reverse decoding · retrained | 0.876 | 0.804 | 0.814 | 0.891 | 0.867 | 0.821 | 0.881 | 0.891 | 0.898 | 0.860 |
| ContraNovo reverse decoding · retrained | 0.909 | 0.815 | 0.865 | 0.923 | 0.901 | 0.849 | 0.919 | 0.907 | 0.925 | 0.890 |
| ByNovo reverse decoding | 0.919 | 0.822 | 0.879 | 0.912 | 0.912 | 0.843 | 0.932 | 0.913 | 0.936 | 0.897 |
| RankNovo | 0.926 | 0.838 | 0.885 | 0.929 | 0.920 | 0.860 | 0.938 | 0.918 | 0.938 | 0.906 |
|
Nine-species benchmark revised (build not stated) |
Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| Casanovo V2 · released | 0.793 | 0.558 | 0.669 | 0.712 | 0.754 | 0.555 | 0.772 | 0.783 | 0.837 | 0.714 |
| ContraNovo · released | 0.815 | 0.575 | 0.711 | 0.820 | 0.780 | 0.616 | 0.799 | 0.794 | 0.854 | 0.752 |
| ByNovo | 0.833 | 0.582 | 0.731 | 0.789 | 0.799 | 0.596 | 0.814 | 0.807 | 0.871 | 0.758 |
| Casanovo reverse decoding · retrained | 0.759 | 0.558 | 0.643 | 0.732 | 0.723 | 0.558 | 0.721 | 0.768 | 0.799 | 0.696 |
| ContraNovo reverse decoding · retrained | 0.821 | 0.581 | 0.719 | 0.815 | 0.779 | 0.620 | 0.804 | 0.798 | 0.861 | 0.755 |
| ByNovo reverse decoding | 0.831 | 0.585 | 0.729 | 0.781 | 0.794 | 0.589 | 0.815 | 0.803 | 0.873 | 0.756 |
| RankNovo | 0.851 | 0.620 | 0.752 | 0.820 | 0.813 | 0.629 | 0.836 | 0.822 | 0.885 | 0.781 |
RankNovo reranks the candidates of six base models. Casanovo V2 and ContraNovo are the released models; ByNovo is RankNovo's own in-house model, with an auxiliary b/y ion-annotation head (its Appendix B.4); R-Casanovo, R-ContraNovo and R-ByNovo are reverse-decoding versions of the three, trained by RankNovo's authors and recorded as the 'reverse decoding' variant. All six were trained on MassIVE-KB and evaluated zero-shot. '†' marks a model that is both baseline and base model, '⋆' one the authors trained. The plain Casanovo row repeats the values other papers print for Casanovo (0.749 and 0.537 on Bacillus) and the paper does not say where they come from.
In the paper: column peptide recall, Human: the original table only bolded RankNovo (0.820); ContraNovo (ContraNovo†) (0.820) ties with it and is bolded here too.
Table6
Universal Biological Sequence Reranking for Improved De Novo Peptide Sequencing, page 17: Evaluation of RankNovo in comparison to baseline and base methods on the 9-species-V1 test set. Bolded entries indicate the best-performing models. The symbol “†” indicates that the model serves as both a baseline and a base model. “⋆” signifies that the base models were developed and trained by us.
The same table is also printed in RankNovo: A Universal Reranking Approach for Robust De Novo Peptide Sequencing (Table1, page 8).
|
Nine-species benchmark original (DeepNovo, 2017) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| PEAKS | 0.719 | 0.586 | 0.633 | 0.639 | 0.673 | 0.600 | 0.644 | 0.728 | 0.748 | 0.663 |
| DeepNovo | 0.742 | 0.602 | 0.630 | 0.610 | 0.694 | 0.623 | 0.679 | 0.731 | 0.750 | 0.673 |
| PointNovo | 0.768 | 0.589 | 0.644 | 0.606 | 0.712 | 0.626 | 0.730 | 0.733 | 0.779 | 0.687 |
| Casanovo | 0.749 | 0.603 | 0.629 | 0.586 | 0.679 | 0.689 | 0.668 | 0.721 | 0.684 | 0.667 |
| Casanovo V2 · released | 0.806 | 0.685 | 0.727 | 0.69 | 0.774 | 0.768 | 0.769 | 0.799 | 0.762 | 0.753 |
| ContraNovo · released | 0.828 | 0.706 | 0.761 | 0.771 | 0.798 | 0.799 | 0.804 | 0.808 | 0.782 | 0.784 |
| ByNovo | 0.858 | 0.723 | 0.791 | 0.767 | 0.823 | 0.803 | 0.836 | 0.828 | 0.804 | 0.804 |
| Casanovo reverse decoding · retrained | 0.804 | 0.699 | 0.728 | 0.719 | 0.769 | 0.776 | 0.782 | 0.795 | 0.762 | 0.759 |
| ContraNovo reverse decoding · retrained | 0.839 | 0.716 | 0.775 | 0.782 | 0.806 | 0.811 | 0.816 | 0.822 | 0.798 | 0.796 |
| ByNovo reverse decoding | 0.855 | 0.724 | 0.794 | 0.762 | 0.821 | 0.81 | 0.835 | 0.831 | 0.762 | 0.799 |
| RankNovo | 0.874 | 0.746 | 0.81 | 0.802 | 0.84 | 0.828 | 0.859 | 0.844 | 0.816 | 0.824 |
|
Nine-species benchmark original (DeepNovo, 2017) |
Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| PEAKS | 0.387 | 0.203 | 0.287 | 0.277 | 0.356 | 0.197 | 0.362 | 0.403 | 0.428 | 0.322 |
| DeepNovo | 0.449 | 0.253 | 0.330 | 0.293 | 0.422 | 0.286 | 0.436 | 0.454 | 0.462 | 0.376 |
| PointNovo | 0.518 | 0.298 | 0.396 | 0.351 | 0.478 | 0.355 | 0.511 | 0.513 | 0.534 | 0.439 |
| Casanovo | 0.537 | 0.330 | 0.406 | 0.341 | 0.478 | 0.426 | 0.506 | 0.521 | 0.490 | 0.448 |
| Casanovo V2 · released | 0.646 | 0.46 | 0.527 | 0.492 | 0.592 | 0.493 | 0.628 | 0.637 | 0.629 | 0.567 |
| ContraNovo · released | 0.684 | 0.487 | 0.576 | 0.624 | 0.628 | 0.563 | 0.676 | 0.655 | 0.669 | 0.618 |
| ByNovo | 0.708 | 0.499 | 0.597 | 0.584 | 0.639 | 0.545 | 0.696 | 0.667 | 0.676 | 0.623 |
| Casanovo reverse decoding · retrained | 0.628 | 0.467 | 0.515 | 0.511 | 0.57 | 0.505 | 0.611 | 0.611 | 0.601 | 0.558 |
| ContraNovo reverse decoding · retrained | 0.682 | 0.499 | 0.583 | 0.606 | 0.621 | 0.566 | 0.673 | 0.654 | 0.664 | 0.616 |
| ByNovo reverse decoding | 0.703 | 0.493 | 0.59 | 0.554 | 0.637 | 0.543 | 0.685 | 0.659 | 0.629 | 0.610 |
| RankNovo | 0.738 | 0.539 | 0.63 | 0.642 | 0.672 | 0.583 | 0.733 | 0.691 | 0.703 | 0.660 |
RankNovo reranks the candidates of six base models. Casanovo V2 and ContraNovo are the released models; ByNovo is RankNovo's own in-house model, with an auxiliary b/y ion-annotation head (its Appendix B.4); R-Casanovo, R-ContraNovo and R-ByNovo are reverse-decoding versions of the three, trained by RankNovo's authors and recorded as the 'reverse decoding' variant. All six were trained on MassIVE-KB and evaluated zero-shot. '†' marks a model that is both baseline and base model, '⋆' one the authors trained. The plain Casanovo row repeats the values other papers print for Casanovo (0.749 and 0.537 on Bacillus) and the paper does not say where they come from. THE TEXT AND THE TABLE DISAGREE on V1: the prose gives RankNovo an amino-acid precision of 0.829 and a peptide recall '6.1%' above ByNovo; the table prints 0.824, and 0.660 against ByNovo's 0.623. The table's values are recorded.
Table1
Universal Biological Sequence Reranking for Improved De Novo Peptide Sequencing, page 7: Evaluation of RankNovo in comparison to baseline and base models on the 9-species-V1 and 9-species-V2 test sets. Bolded entries indicate the best-performing models. The symbol “†” indicates that the model serves as both a baseline and a base model. “⋆” signifies that the base models were developed and trained by us. Here, ByNovo is the best base model. So the performance of three self-trained base models (R-Casa, R-Contra, R-By) is only provided in Appendix D.1.
| Nine-species benchmark | Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| PEAKS | 0.719 | 0.586 | 0.633 | 0.639 | 0.673 | 0.600 | 0.644 | 0.728 | 0.748 | 0.663 |
| DeepNovo | 0.742 | 0.602 | 0.630 | 0.610 | 0.694 | 0.623 | 0.679 | 0.731 | 0.750 | 0.673 |
| PointNovo | 0.768 | 0.589 | 0.644 | 0.606 | 0.712 | 0.626 | 0.730 | 0.733 | 0.779 | 0.687 |
| Casanovo | 0.749 | 0.603 | 0.629 | 0.586 | 0.679 | 0.689 | 0.668 | 0.721 | 0.684 | 0.667 |
| Casanovo V2 · released | 0.888 | 0.791 | 0.823 | 0.872 | 0.877 | 0.813 | 0.891 | 0.891 | 0.915 | 0.862 |
| ContraNovo · released | 0.901 | 0.807 | 0.848 | 0.920 | 0.896 | 0.839 | 0.913 | 0.898 | 0.919 | 0.882 |
| ByNovo | 0.920 | 0.823 | 0.876 | 0.917 | 0.914 | 0.841 | 0.932 | 0.912 | 0.934 | 0.897 |
| RankNovo | 0.926 | 0.838 | 0.885 | 0.929 | 0.920 | 0.860 | 0.938 | 0.918 | 0.938 | 0.906 |
| Nine-species benchmark | Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Apis mellifera | Homo sapiens | Methanosarcina mazei | Mus musculus | Vigna mungo | Solanum lycopersicum | Saccharomyces cerevisiae | Average | |
| PEAKS | 0.387 | 0.203 | 0.287 | 0.277 | 0.356 | 0.197 | 0.362 | 0.403 | 0.428 | 0.322 |
| DeepNovo | 0.449 | 0.253 | 0.330 | 0.293 | 0.422 | 0.286 | 0.436 | 0.454 | 0.462 | 0.376 |
| PointNovo | 0.518 | 0.298 | 0.396 | 0.351 | 0.478 | 0.355 | 0.511 | 0.513 | 0.534 | 0.439 |
| Casanovo | 0.537 | 0.330 | 0.406 | 0.341 | 0.478 | 0.426 | 0.506 | 0.521 | 0.490 | 0.448 |
| Casanovo V2 · released | 0.793 | 0.558 | 0.669 | 0.712 | 0.754 | 0.555 | 0.772 | 0.783 | 0.837 | 0.714 |
| ContraNovo · released | 0.815 | 0.575 | 0.711 | 0.820 | 0.780 | 0.616 | 0.799 | 0.794 | 0.854 | 0.752 |
| ByNovo | 0.833 | 0.582 | 0.731 | 0.789 | 0.799 | 0.596 | 0.814 | 0.807 | 0.871 | 0.758 |
| RankNovo | 0.851 | 0.620 | 0.752 | 0.820 | 0.813 | 0.629 | 0.836 | 0.822 | 0.885 | 0.781 |
RankNovo reranks the candidates of six base models. Casanovo V2 and ContraNovo are the released models; ByNovo is RankNovo's own in-house model, with an auxiliary b/y ion-annotation head (its Appendix B.4); R-Casanovo, R-ContraNovo and R-ByNovo are reverse-decoding versions of the three, trained by RankNovo's authors and recorded as the 'reverse decoding' variant. All six were trained on MassIVE-KB and evaluated zero-shot. '†' marks a model that is both baseline and base model, '⋆' one the authors trained. The plain Casanovo row repeats the values other papers print for Casanovo (0.749 and 0.537 on Bacillus) and the paper does not say where they come from. THE TEXT AND THE TABLE DISAGREE on V1: the prose gives RankNovo an amino-acid precision of 0.829 and a peptide recall '6.1%' above ByNovo; the table prints 0.824, and 0.660 against ByNovo's 0.623. The table's values are recorded.
In the paper: column amino acid precision, Average: the original table bolded RankNovo (0.824), RankNovo (0.906).
In the paper: column amino acid precision, Bacillus: the original table bolded RankNovo (0.874), RankNovo (0.926).
In the paper: column amino acid precision, C. bacteria: the original table bolded RankNovo (0.746), RankNovo (0.838).
In the paper: column amino acid precision, Honeybee: the original table bolded RankNovo (0.810), RankNovo (0.885).
In the paper: column amino acid precision, Human: the original table bolded RankNovo (0.802), RankNovo (0.929).
In the paper: column amino acid precision, M. mazei: the original table bolded RankNovo (0.840), RankNovo (0.920).
In the paper: column amino acid precision, Mouse: the original table bolded RankNovo (0.828), RankNovo (0.860).
In the paper: column amino acid precision, Ricebean: the original table bolded RankNovo (0.859), RankNovo (0.938).
In the paper: column amino acid precision, Tomato: the original table bolded RankNovo (0.844), RankNovo (0.918).
In the paper: column amino acid precision, Yeast: the original table bolded RankNovo (0.816), RankNovo (0.938).
In the paper: column peptide recall, Average: the original table bolded RankNovo (0.660), RankNovo (0.781).
In the paper: column peptide recall, Bacillus: the original table bolded RankNovo (0.738), RankNovo (0.851).
In the paper: column peptide recall, C. bacteria: the original table bolded RankNovo (0.539), RankNovo (0.620).
In the paper: column peptide recall, Honeybee: the original table bolded RankNovo (0.630), RankNovo (0.752).
In the paper: column peptide recall, Human: the original table bolded RankNovo (0.642), RankNovo (0.820).
In the paper: column peptide recall, M. mazei: the original table bolded RankNovo (0.672), RankNovo (0.813).
In the paper: column peptide recall, Mouse: the original table bolded RankNovo (0.583), RankNovo (0.629).
In the paper: column peptide recall, Ricebean: the original table bolded RankNovo (0.733), RankNovo (0.836).
In the paper: column peptide recall, Tomato: the original table bolded RankNovo (0.691), RankNovo (0.822).
In the paper: column peptide recall, Yeast: the original table bolded RankNovo (0.703), RankNovo (0.885).
Pairwise Attention: Leveraging Mass Differences to Enhance De Novo Sequencing of Mass Spectra (2025) · 3 tables
Table3
Pairwise Attention: Leveraging Mass Differences to Enhance De Novo Sequencing of Mass Spectra, page 8: Performance after training the models on the MassIVE-KB set. Here we tested on each of the species in the nine-species dataset and report peptide precision at 100% coverage. The models tested are Base and PA, alongside Casanovo’s reported numbers7.
|
Nine-species benchmark revised (MassIVE 2024) |
Peptide precision at coverage 1 | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Apis mellifera | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Homo sapiens | Methanosarcina mazei | Mus musculus | Solanum lycopersicum | Saccharomyces cerevisiae | Vigna mungo | Average | |
| Pairwise base | 0.618 | 0.706 | 0.525 | 0.737 | 0.700 | 0.563 | 0.735 | 0.765 | 0.753 | 0.678 |
| Pairwise | 0.640 | 0.732 | 0.549 | 0.746 | 0.720 | 0.579 | 0.751 | 0.784 | 0.783 | 0.698 |
| Casanovo · quoted | 0.662 | 0.778 | 0.656 | 0.740 | 0.710 | 0.552 | 0.799 | 0.840 | 0.762 | 0.722 |
Table2 (Nine-species · revised (build not stated))
Pairwise Attention: Leveraging Mass Differences to Enhance De Novo Sequencing of Mass Spectra, page 7: Peptide precision at 100% coverage as measured on the V1 and V2 of the nine-species dataset. Here, Base denotes our implementation of a standard transformer, i.e. without pairwise features. PA is our implementation of pairwise attention, and Casanovo is the reported numbers for Casanovo bm in the original publication7. For PA we report the average of 3 runs at seeds 0, 10, and 20, with standard deviation in parentheses.
|
Nine-species benchmark revised (MassIVE 2024) |
Peptide precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Apis mellifera | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Homo sapiens | Methanosarcina mazei | Mus musculus | Solanum lycopersicum | Saccharomyces cerevisiae | Vigna mungo | Average | |
| Pairwise base | 0.390 | 0.494 | 0.356 | 0.451 | 0.509 | 0.410 | 0.543 | 0.558 | 0.525 | 0.471 |
| Pairwise | 0.446 | 0.583 | 0.425 | 0.521 | 0.579 | 0.435 | 0.623 | 0.631 | 0.598 | 0.538 |
| Casanovo · quoted | 0.456 | 0.538 | 0.468 | 0.533 | 0.529 | 0.395 | 0.608 | 0.561 | 0.428 | 0.502 |
Table2 (Nine-species · original (DeepNovo, 2017))
Pairwise Attention: Leveraging Mass Differences to Enhance De Novo Sequencing of Mass Spectra, page 7: Peptide precision at 100% coverage as measured on the V1 and V2 of the nine-species dataset. Here, Base denotes our implementation of a standard transformer, i.e. without pairwise features. PA is our implementation of pairwise attention, and Casanovo is the reported numbers for Casanovo bm in the original publication7. For PA we report the average of 3 runs at seeds 0, 10, and 20, with standard deviation in parentheses.
|
Nine-species benchmark original (DeepNovo, 2017) |
Peptide precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Apis mellifera | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Homo sapiens | Methanosarcina mazei | Mus musculus | Solanum lycopersicum | Saccharomyces cerevisiae | Vigna mungo | Average | |
| Pairwise base | 0.390 | 0.536 | 0.357 | 0.340 | 0.503 | 0.433 | 0.509 | 0.537 | 0.570 | 0.464 |
| Pairwise | 0.463 | 0.612 | 0.409 | 0.391 | 0.554 | 0.472 | 0.590 | 0.612 | 0.625 | 0.523 |
| Casanovo · quoted | 0.433 | 0.573 | 0.390 | 0.383 | 0.515 | 0.431 | 0.522 | 0.580 | 0.552 | 0.487 |
A transformer-based semi-autoregressive framework for high-speed and accurate de novo peptide sequencing (2025) · 1 table
Table1
A transformer-based semi-autoregressive framework for high-speed and accurate de novo peptide sequencing, page 5: Comparative Results of TSARseqNovo, CasaNovo, and π-HelixNovo on the Nine-Species Dataset
| Nine-species benchmark | Peptide precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Candidatus Thiodiazotropha endoloripes | Homo sapiens | Apis mellifera | Mus musculus | Solanum lycopersicum | Methanosarcina mazei | Bacillus subtilis | Saccharomyces cerevisiae | Vigna mungo | Average | |
| TSARseqNovo | 0.419 | 0.430 | 0.512 | 0.532 | 0.571 | 0.582 | 0.612 | 0.618 | 0.637 | 0.535 |
| Casanovo | 0.371‡ | 0.346‡ | 0.408‡ | 0.442‡ | 0.461‡ | 0.486‡ | 0.540‡ | 0.505‡ | 0.523‡ | 0.445‡ |
| π-HelixNovo | 0.388‡ | 0.392‡ | 0.473‡ | 0.483‡ | 0.560‡ | 0.560‡ | 0.596‡ | 0.568‡ | 0.623‡ | 0.503‡ |
| Nine-species benchmark | Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Candidatus Thiodiazotropha endoloripes | Homo sapiens | Apis mellifera | Mus musculus | Solanum lycopersicum | Methanosarcina mazei | Bacillus subtilis | Saccharomyces cerevisiae | Vigna mungo | Average | |
| TSARseqNovo | 0.706 | 0.677 | 0.755 | 0.812 | 0.793 | 0.783 | 0.827 | 0.792 | 0.835 | 0.776 |
| Casanovo | 0.621‡ | 0.585‡ | 0.638‡ | 0.709‡ | 0.674‡ | 0.704‡ | 0.744‡ | 0.705‡ | 0.718‡ | 0.678‡ |
| π-HelixNovo | 0.681‡ | 0.665‡ | 0.721‡ | 0.765‡ | 0.771‡ | 0.784‡ | 0.816‡ | 0.768‡ | 0.793‡ | 0.752‡ |
| Nine-species benchmark | Amino acid recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Candidatus Thiodiazotropha endoloripes | Homo sapiens | Apis mellifera | Mus musculus | Solanum lycopersicum | Methanosarcina mazei | Bacillus subtilis | Saccharomyces cerevisiae | Vigna mungo | Average | |
| TSARseqNovo | 0.699 | 0.683 | 0.767 | 0.822 | 0.786 | 0.795 | 0.828 | 0.799 | 0.833 | 0.779 |
| Casanovo | 0.624‡ | 0.591‡ | 0.640‡ | 0.709‡ | 0.675‡ | 0.705‡ | 0.745‡ | 0.706‡ | 0.719‡ | 0.679‡ |
| π-HelixNovo | 0.668‡ | 0.667‡ | 0.729‡ | 0.767‡ | 0.771‡ | 0.784‡ | 0.817‡ | 0.744‡ | 0.797‡ | 0.749‡ |
‡ Not printed in the paper: computed from the differences it prints, as described under the table.
The original table prints only TSARseqNovo's scores, each followed by two 'vs' rows giving its improvement in percentage points over CasaNovo and pi-HelixNovo. The CasaNovo and pi-HelixNovo values here are computed as TSARseqNovo minus that improvement; they are not printed in the paper. The table also misspells pi-HelixNovo as 'pi-HelexiNovo'.
Distilling Non-Autoregressive Model Knowledge for Autoregressive De Novo Peptide Sequencing (2025) · 1 table
Table1
Distilling Non-Autoregressive Model Knowledge for Autoregressive De Novo Peptide Sequencing, page 7: Comparison of the performance of CrossNovo and baseline methods on 9-species-v1 test set. The bold font indicates the best performance.
|
Nine-species benchmark original (DeepNovo, 2017) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| PEAKS | 0.600 | 0.639 | 0.748 | 0.673 | 0.633 | 0.728 | 0.644 | 0.719 | 0.586 | 0.663 |
| π-PrimeNovo | 0.784 | 0.729 | 0.802 | 0.801 | 0.763 | 0.815 | 0.822 | 0.846 | 0.734 | 0.788 |
| DeepNovo | 0.623 | 0.610 | 0.750 | 0.694 | 0.630 | 0.731 | 0.679 | 0.742 | 0.602 | 0.673 |
| PointNovo | 0.626 | 0.606 | 0.779 | 0.712 | 0.644 | 0.733 | 0.730 | 0.768 | 0.589 | 0.687 |
| Casanovo | 0.689 | 0.586 | 0.684 | 0.679 | 0.629 | 0.721 | 0.668 | 0.749 | 0.603 | 0.667 |
| Casanovo V2 | 0.760 | 0.676 | 0.752 | 0.755 | 0.706 | 0.785 | 0.748 | 0.790 | 0.681 | 0.739 |
| ContraNovo | 0.798 | 0.771 | 0.797 | 0.799 | 0.745 | 0.810 | 0.807 | 0.828 | 0.711 | 0.785 |
| CrossNovo | 0.816 | 0.800 | 0.814 | 0.826 | 0.785 | 0.830 | 0.831 | 0.856 | 0.740 | 0.811 |
|
Nine-species benchmark original (DeepNovo, 2017) |
Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| PEAKS | 0.197 | 0.277 | 0.428 | 0.356 | 0.287 | 0.403 | 0.362 | 0.387 | 0.203 | 0.322 |
| π-PrimeNovo | 0.567 | 0.574 | 0.697 | 0.650 | 0.603 | 0.697 | 0.702 | 0.721 | 0.531 | 0.638 |
| DeepNovo | 0.286 | 0.293 | 0.462 | 0.422 | 0.330 | 0.454 | 0.436 | 0.449 | 0.253 | 0.376 |
| PointNovo | 0.355 | 0.351 | 0.534 | 0.478 | 0.396 | 0.513 | 0.511 | 0.518 | 0.298 | 0.439 |
| Casanovo | 0.426 | 0.341 | 0.490 | 0.478 | 0.406 | 0.521 | 0.506 | 0.537 | 0.330 | 0.448 |
| Casanovo V2 | 0.483 | 0.446 | 0.599 | 0.557 | 0.493 | 0.618 | 0.589 | 0.622 | 0.446 | 0.539 |
| ContraNovo | 0.567 | 0.622 | 0.674 | 0.630 | 0.576 | 0.672 | 0.677 | 0.688 | 0.486 | 0.621 |
| CrossNovo | 0.596 | 0.661 | 0.698 | 0.660 | 0.610 | 0.695 | 0.716 | 0.726 | 0.518 | 0.654 |
In the paper: column peptide recall, Mouse: the original table only underlined ContraNovo (Contra.) (0.567); π-PrimeNovo (Prime.) (0.567) ties with it and is underlined here too.
π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing (2025) · 5 tables
SupplementaryTable7
π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing, page 30: The performance of PrimeNovo compared to Casanovo and Casanovo V2 on six different proteolytic enzymes in the IgG1-Human-HC dataset.
The same table is also printed in π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing (SupplementaryTable7, page 36).
|
Monoclonal antibody de novo assembly as deposited |
Amino acid precision | Peptide recall | ||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| HC AspN | HC Chymotrypsin | HC GluC | HC LysC | HC Proteinase K | HC Trypsin | HC AspN | HC Chymotrypsin | HC GluC | HC LysC | HC Proteinase K | HC Trypsin | |
| Casanovo | 0.3089 | 0.2114 | 0.2878 | 0.4359 | 0.3844 | 0.4395 | 0.0726 | 0.0298 | 0.0686 | 0.2108 | 0.089 | 0.1703 |
| Casanovo V2 | 0.5236 | 0.4794 | 0.5214 | 0.7002 | 0.6735 | 0.7374 | 0.2611 | 0.2493 | 0.3133 | 0.5224 | 0.4568 | 0.5483 |
| π-PrimeNovo | 0.6059 | 0.6227 | 0.6427 | 0.749 | 0.7567 | 0.7818 | 0.3593 | 0.446 | 0.4625 | 0.6204 | 0.5972 | 0.6649 |
SupplementaryTable6
π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing, page 29: The average performance of PrimeNovo compared to Casanovo and Casanovo V2 across four distinct large-scale MS/MS datasets.
The same table is also printed in π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing (SupplementaryTable6, page 35).
| a dataset per evaluation set | Amino acid precision | Peptide recall | ||||||
|---|---|---|---|---|---|---|---|---|
| HCC | IgG1-Human-HC | PT | Three-species | HCC | IgG1-Human-HC | PT | Three-species | |
| Casanovo | 0.0908 | 0.34465 | 0.4443 | 0.5633 | 0.0001 | 0.1154 | 0.2873 | 0.5037 |
| Casanovo V2 | 0.4968 | 0.605917000 | 0.6284 | 0.8167 | 0.161 | 0.4065 | 0.4543 | 0.6873 |
| π-PrimeNovo | 0.5793 | 0.693133000 | 0.7307 | 0.8767 | 0.3817 | 0.5416 | 0.5857 | 0.7867 |
SupplementaryTable5
π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing, page 28: Peptide recall on the revised nine-species benchmark dataset. Note: the bold text indicates the highest performance in each row.
The same table is also printed in π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing (SupplementaryTable5, page 33).
|
Nine-species benchmark revised (MassIVE 2022) |
Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Apis mellifera | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Homo sapiens | Methanosarcina mazei | Mus musculus | Saccharomyces cerevisiae | Solanum lycopersicum | Vigna mungo | Average | |
| Casanovo | 0.3578 | 0.4637 | 0.3055 | 0.4468 | 0.4927 | 0.4063 | 0.4657 | 0.4354 | 0.3977 | 0.4191 |
| Casanovo V2 | 0.57 | 0.71 | 0.51 | 0.65 | 0.68 | 0.52 | 0.73 | 0.69 | 0.7 | 0.64 |
| π-PrimeNovo | 0.70 | 0.80 | 0.59 | 0.75 | 0.78 | 0.60 | 0.83 | 0.78 | 0.84 | 0.74 |
SupplementaryTable4
π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing, page 27: Amino acid precision on the nine-species benchmark dataset. Note: the bold text indicates the highest performance in each row.
The same table is also printed in π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing (SupplementaryTable4, page 33).
| Nine-species benchmark | Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Apis mellifera | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Homo sapiens | Methanosarcina mazei | Mus musculus | Saccharomyces cerevisiae | Solanum lycopersicum | Vigna mungo | Average | |
| PEAKS | 0.63 | 0.72 | 0.59 | 0.64 | 0.67 | 0.60 | 0.75 | 0.73 | 0.64 | 0.66 |
| DeepNovo | 0.63 | 0.74 | 0.60 | 0.61 | 0.69 | 0.62 | 0.75 | 0.73 | 0.68 | 0.67 |
| PointNovo | 0.64 | 0.77 | 0.59 | 0.61 | 0.71 | 0.63 | 0.78 | 0.73 | 0.73 | 0.69 |
| Casanovo | 0.63 | 0.75 | 0.60 | 0.59 | 0.68 | 0.69 | 0.68 | 0.72 | 0.67 | 0.67 |
| Casanovo V2 | 0.71 | 0.79 | 0.68 | 0.68 | 0.76 | 0.76 | 0.75 | 0.79 | 0.75 | 0.74 |
| π-PrimeNovo | 0.76 | 0.84 | 0.72 | 0.72 | 0.80 | 0.78 | 0.80 | 0.82 | 0.82 | 0.79 |
Supplementary Table 3
π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing, page 26: Peptide recall on the nine-species benchmark dataset. Note: the bold text indicates the highest performance in each row.
The same table is also printed in π-PrimeNovo: an accurate and efficient non-autoregressive deep learning model for de novo peptide sequencing (Supplementary Table 3, page 31).
| Nine-species benchmark | Peptide recall | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Apis mellifera | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Homo sapiens | Methanosarcina mazei | Mus musculus | Saccharomyces cerevisiae | Solanum lycopersicum | Vigna mungo | Average | |
| PEAKS | 0.29 | 0.39 | 0.20 | 0.28 | 0.36 | 0.20 | 0.43 | 0.40 | 0.36 | 0.32 |
| PepNet | 0.28 | 0.42 | 0.24 | 0.23 | 0.38 | 0.28 | 0.37 | 0.43 | 0.32 | 0.33 |
| DeepNovo | 0.33 | 0.45 | 0.25 | 0.29 | 0.42 | 0.29 | 0.46 | 0.45 | 0.44 | 0.38 |
| PointNovo | 0.40 | 0.52 | 0.30 | 0.35 | 0.48 | 0.36 | 0.53 | 0.51 | 0.51 | 0.44 |
| Casanovo | 0.41 | 0.54 | 0.33 | 0.34 | 0.48 | 0.43 | 0.49 | 0.52 | 0.51 | 0.45 |
| Casanovo V2 | 0.49 | 0.62 | 0.45 | 0.45 | 0.56 | 0.48 | 0.60 | 0.62 | 0.59 | 0.54 |
| π-PrimeNovo | 0.60 | 0.72 | 0.53 | 0.57 | 0.65 | 0.57 | 0.70 | 0.70 | 0.70 | 0.64 |
AdaNovo: Towards Robust De Novo Peptide Sequencing in Proteomics against Data Biases (2024) · 4 tables
Table4
AdaNovo: Towards Robust De Novo Peptide Sequencing in Proteomics against Data Biases, page 8: Comparisons with alternative methods in terms of identifying amino acids with PTMs. All results are reported using the yeast dataset as test set.
Table3
AdaNovo: Towards Robust De Novo Peptide Sequencing in Proteomics against Data Biases, page 8: Models’ Performance on mass spectrum dataset with synthetic noise. The results are reported using the Clam bacteria as test set.
| Nine-species benchmark | Amino acid precision | Peptide precision |
|---|---|---|
| Casanovo · retrained | 0.582 | 0.297 |
| AdaNovo w/o PSM-level objective | 0.617 | 0.336 |
| AdaNovo w/o AA-level objective | 0.644 | 0.372 |
| AdaNovo | 0.656 | 0.397 |
Table2
AdaNovo: Towards Robust De Novo Peptide Sequencing in Proteomics against Data Biases, page 8: Ablations on amino acid-level (AA-level) and peptide-level training strategies. The results are reported using the Human datasets as test set.
| Nine-species benchmark | Amino acid precision | Peptide precision | Ptm precision |
|---|---|---|---|
| Homo sapiens | Homo sapiens | Homo sapiens | |
| Casanovo · retrained | 0.585 | 0.343 | 0.300 |
| AdaNovo w/o PSM-level objective | 0.607 | 0.360 | 0.478 |
| AdaNovo w/o AA-level objective | 0.594 | 0.349 | 0.314 |
| AdaNovo | 0.618 | 0.373 | 0.483 |
Table1
AdaNovo: Towards Robust De Novo Peptide Sequencing in Proteomics against Data Biases, page 7: Empirical comparison of previous models on 9-species benchmark. The best and the second best results are highlighted with bold and underlined, respectively. The reproduced performance of Casanovo is denoted as Casanovo (rep.). Following Casanovo [35], we train 5 models with different random initializations and report the standard deviation when the test dataset is Mouse or Human. The other standard deviations are not reported because it would be too computationally expensive.
| Nine-species benchmark | Peptide precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| DeepNovo · quoted | 0.286 | 0.293 | 0.462 | 0.422 | 0.330 | 0.454 | 0.436 | 0.449 | 0.253 | 0.376 |
| PointNovo · quoted | 0.355 | 0.351 | 0.534 | 0.478 | 0.396 | 0.513 | 0.511 | 0.518 | 0.298 | 0.439 |
| Casanovo · quoted | 0.443 | 0.367 | 0.561 | 0.486 | 0.408 | 0.460 | 0.437 | 0.540 | 0.371 | 0.453 |
| Casanovo rep. · retrained | 0.449 | 0.343 | 0.568 | 0.474 | 0.422 | 0.463 | 0.549 | 0.513 | 0.347 | 0.459 |
| AdaNovo | 0.493 | 0.373 | 0.612 | 0.523 | 0.431 | 0.552 | 0.546 | 0.561 | 0.397 | 0.499 |
| Nine-species benchmark | Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| DeepNovo · quoted | 0.623 | 0.610 | 0.750 | 0.694 | 0.630 | 0.731 | 0.679 | 0.742 | 0.602 | 0.673 |
| PointNovo · quoted | 0.626 | 0.606 | 0.779 | 0.712 | 0.644 | 0.733 | 0.730 | 0.768 | 0.589 | 0.687 |
| Casanovo · quoted | 0.562 | 0.424 | 0.591 | 0.518 | 0.461 | 0.471 | 0.442 | 0.573 | 0.405 | 0.494 |
| Casanovo rep. · retrained | 0.612 | 0.585 | 0.753 | 0.686 | 0.640 | 0.720 | 0.727 | 0.711 | 0.617 | 0.672 |
| AdaNovo | 0.667 | 0.618 | 0.825 | 0.757 | 0.650 | 0.767 | 0.719 | 0.788 | 0.656 | 0.716 |
The plain Casanovo column is quoted: each value is Casanovo's own Table 2 precision at coverage 1, set here under AdaNovo's precision. AdaNovo's own run of Casanovo is 'Casanovo (rep.)', the column the arXiv version prints as plain 'Casanovo'.
In the paper: column amino acid precision, Bacillus: the original table bolded PointNovo (0.768), AdaNovo (0.788) and underlined DeepNovo (0.742).
ReNovo: Retrieval-Based De Novo Mass Spectrometry Peptide Sequencing (2024) · 3 tables
Table1 (Seven-species)
ReNovo: Retrieval-Based De Novo Mass Spectrometry Peptide Sequencing, page 7: Empirical comparison of de novo peptide sequencing models. The best and the second best are highlighted with bold and underline, respectively.
|
Seven-species benchmark NovoBench split |
Peptide precision | Peptide AUC | Amino acid precision | Amino acid recall |
|---|---|---|---|---|
| DeepNovo | 0.204 | 0.136 | 0.492 | 0.433 |
| PointNovo | 0.022 | 0.007 | 0.196 | 0.169 |
| Casanovo | 0.119 | 0.084 | 0.322 | 0.327 |
| π-HelixNovo | 0.234 | 0.173 | 0.481 | 0.472 |
| AdaNovo | 0.174 | 0.135 | 0.379 | 0.385 |
| ReNovo | 0.278 | 0.228 | 0.512 | 0.514 |
Table1 (Nine-species)
ReNovo: Retrieval-Based De Novo Mass Spectrometry Peptide Sequencing, page 7: Empirical comparison of de novo peptide sequencing models. The best and the second best are highlighted with bold and underline, respectively.
| Nine-species benchmark | Peptide precision | Peptide AUC | Amino acid precision | Amino acid recall |
|---|---|---|---|---|
| DeepNovo | 0.428 | 0.376 | 0.696 | 0.638 |
| PointNovo | 0.480 | 0.436 | 0.740 | 0.671 |
| Casanovo | 0.481 | 0.439 | 0.697 | 0.696 |
| π-HelixNovo | 0.517 | 0.453 | 0.765 | 0.758 |
| AdaNovo | 0.505 | 0.469 | 0.698 | 0.709 |
| ReNovo | 0.568 | 0.528 | 0.770 | 0.769 |
Table1 (HC-PT)
ReNovo: Retrieval-Based De Novo Mass Spectrometry Peptide Sequencing, page 7: Empirical comparison of de novo peptide sequencing models. The best and the second best are highlighted with bold and underline, respectively.
|
ProteomeTools HC-PT (NovoBench) |
Peptide precision | Peptide AUC | Amino acid precision | Amino acid recall |
|---|---|---|---|---|
| DeepNovo | 0.313 | 0.255 | 0.531 | 0.534 |
| PointNovo | 0.419 | 0.373 | 0.623 | 0.622 |
| Casanovo | 0.211 | 0.177 | 0.442 | 0.453 |
| π-HelixNovo | 0.356 | 0.318 | 0.588 | 0.582 |
| AdaNovo | 0.212 | 0.178 | 0.442 | 0.451 |
| ReNovo | 0.467 | 0.436 | 0.651 | 0.648 |
ContraNovo: A Contrastive Learning Approach to Enhance De Novo Peptide Sequencing (2024) · 2 tables
Table2
ContraNovo: A Contrastive Learning Approach to Enhance De Novo Peptide Sequencing, page 7: Comparison of the performance of ContraNovo and CasaNovoV2 methods on 9-species-V2 test set. The bold font indicates the best performance.
|
Nine-species benchmark revised (build not stated) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| Casanovo V2 | 0.792 | 0.836 | 0.851 | 0.828 | 0.759 | 0.823 | 0.858 | 0.852 | 0.760 | 0.818 |
| ContraNovo | 0.816 | 0.893 | 0.875 | 0.863 | 0.804 | 0.860 | 0.909 | 0.861 | 0.778 | 0.851 |
|
Nine-species benchmark revised (build not stated) |
Peptide precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| Casanovo V2 | 0.520 | 0.651 | 0.729 | 0.675 | 0.572 | 0.692 | 0.702 | 0.717 | 0.505 | 0.640 |
| ContraNovo | 0.566 | 0.745 | 0.719 | 0.716 | 0.608 | 0.716 | 0.791 | 0.713 | 0.521 | 0.677 |
Table 1
ContraNovo: A Contrastive Learning Approach to Enhance De Novo Peptide Sequencing, page 6: Comparison of the performance of ContraNovo and five baseline methods on 9-species-V1 test set. The bold font indicates the best performance.
|
Nine-species benchmark original (DeepNovo, 2017) |
Amino acid precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| PEAKS | 0.600 | 0.639 | 0.748 | 0.673 | 0.633 | 0.728 | 0.644 | 0.719 | 0.586 | 0.663 |
| DeepNovo | 0.623 | 0.610 | 0.750 | 0.694 | 0.630 | 0.731 | 0.679 | 0.742 | 0.602 | 0.673 |
| PointNovo | 0.626 | 0.606 | 0.779 | 0.712 | 0.644 | 0.733 | 0.730 | 0.768 | 0.589 | 0.687 |
| Casanovo | 0.689 | 0.586 | 0.684 | 0.679 | 0.629 | 0.721 | 0.668 | 0.749 | 0.603 | 0.667 |
| Casanovo V2 | 0.760 | 0.676 | 0.752 | 0.755 | 0.706 | 0.785 | 0.748 | 0.790 | 0.681 | 0.739 |
| ContraNovo | 0.798 | 0.771 | 0.797 | 0.799 | 0.745 | 0.810 | 0.807 | 0.828 | 0.711 | 0.785 |
|
Nine-species benchmark original (DeepNovo, 2017) |
Peptide precision | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | Average | |
| PEAKS | 0.197 | 0.277 | 0.428 | 0.356 | 0.287 | 0.403 | 0.362 | 0.387 | 0.203 | 0.322 |
| DeepNovo | 0.286 | 0.293 | 0.462 | 0.422 | 0.330 | 0.454 | 0.436 | 0.449 | 0.253 | 0.376 |
| PointNovo | 0.355 | 0.351 | 0.534 | 0.478 | 0.396 | 0.513 | 0.511 | 0.518 | 0.298 | 0.439 |
| Casanovo | 0.426 | 0.341 | 0.490 | 0.478 | 0.406 | 0.521 | 0.506 | 0.537 | 0.330 | 0.448 |
| Casanovo V2 | 0.483 | 0.446 | 0.599 | 0.557 | 0.493 | 0.618 | 0.589 | 0.622 | 0.446 | 0.539 |
| ContraNovo | 0.567 | 0.622 | 0.674 | 0.630 | 0.576 | 0.672 | 0.677 | 0.688 | 0.486 | 0.621 |
AdaNovo: Adaptive De Novo Peptide Sequencing with Conditional Mutual Information (2024) · 5 tables
Table5
AdaNovo: Adaptive De Novo Peptide Sequencing with Conditional Mutual Information, page 8: Comparisons with alternative methods in terms of identi- to reduced precision in identification. To address these isfying amino acids with PTMs. All results are for the yeast test set, sues, we introduce a novel approach involving the calculawhich is one of 9-species benchmark (Tran et al., 2017). tion of conditional mutual information between the spec-
Table4
AdaNovo: Adaptive De Novo Peptide Sequencing with Conditional Mutual Information, page 8: Models’ Performance on mass spectrum dataset with syn- datasets are derived from different species, there exists a thetic noise. The results are for the Clam bacteria test set, which is significant difference in the distribution of PTMs quantities.
| Nine-species benchmark | Amino acid precision | Peptide precision |
|---|---|---|
| Casanovo · retrained | 0.582 | 0.297 |
| AdaNovo w/o PSM-level MI | 0.586 | 0.311 |
| AdaNovo w/o AA-level CMI | 0.614 | 0.335 |
| AdaNovo | 0.621 | 0.342 |
Table3
AdaNovo: Adaptive De Novo Peptide Sequencing with Conditional Mutual Information, page 8: Ablations on amino acid-level (AA-level) and peptidelevel adaptive training strategies. The results are for the Human test set, which is one of 9-species benchmark (Tran et al., 2017).
| Nine-species benchmark | Amino acid precision | Peptide precision | Ptm precision |
|---|---|---|---|
| Homo sapiens | Homo sapiens | Homo sapiens | |
| Casanovo · retrained | 0.585 | 0.343 | 0.300 |
| AdaNovo w/o PSM-level MI | 0.607 | 0.360 | 0.478 |
| AdaNovo w/o AA-level CMI | 0.594 | 0.349 | 0.314 |
| AdaNovo | 0.618 | 0.373 | 0.483 |
Table2
AdaNovo: Adaptive De Novo Peptide Sequencing with Conditional Mutual Information, page 7: Empirical comparison of de novo sequencing models in terms of identifying amino acids with PTMs. The best and the second best results are highlighted bold and underlined, respectively.
| Nine-species benchmark | Ptm precision | |||
|---|---|---|---|---|
| Homo sapiens | Vigna mungo | Candidatus Thiodiazotropha endoloripes | Bacillus subtilis | |
| DeepNovo · quoted | 0.369 | 0.644 | 0.510 | 0.483 |
| PointNovo · quoted | 0.415 | 0.653 | 0.526 | 0.524 |
| Casanovo · retrained | 0.398 | 0.646 | 0.508 | 0.470 |
| AdaNovo | 0.483 | 0.689 | 0.575 | 0.565 |
Table1
AdaNovo: Adaptive De Novo Peptide Sequencing with Conditional Mutual Information, page 7: Empirical comparison of de novo sequencing models. The table lists the peptide-level and amino acid-level precision of three competing models on all nine benchmark cross-validation folds. Each fold’s test set contains spectra from a single species. Kindly note that peptide-level performance measures are the primary quantifier of the model’s practical utility because the goal is to assign a complete peptide sequence to each spectrum. The best and the second best results are highlighted bold and underlined, respectively.
| Nine-species benchmark | Peptide precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | |
| DeepNovo · quoted | 0.286 | 0.293 | 0.462 | 0.422 | 0.330 | 0.454 | 0.436 | 0.449 | 0.253 |
| PointNovo · quoted | 0.355 | 0.351 | 0.534 | 0.478 | 0.396 | 0.513 | 0.511 | 0.518 | 0.298 |
| Casanovo · retrained | 0.449 | 0.343 | 0.568 | 0.474 | 0.422 | 0.463 | 0.549 | 0.513 | 0.347 |
| AdaNovo | 0.467 | 0.373 | 0.593 | 0.496 | 0.431 | 0.530 | 0.546 | 0.528 | 0.372 |
| Nine-species benchmark | Amino acid precision | ||||||||
|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | Homo sapiens | Saccharomyces cerevisiae | Methanosarcina mazei | Apis mellifera | Solanum lycopersicum | Vigna mungo | Bacillus subtilis | Candidatus Thiodiazotropha endoloripes | |
| DeepNovo · quoted | 0.623 | 0.610 | 0.750 | 0.694 | 0.630 | 0.731 | 0.679 | 0.742 | 0.602 |
| PointNovo · quoted | 0.626 | 0.606 | 0.779 | 0.712 | 0.644 | 0.733 | 0.730 | 0.768 | 0.589 |
| Casanovo · retrained | 0.612 | 0.585 | 0.753 | 0.686 | 0.640 | 0.720 | 0.727 | 0.718 | 0.617 |
| AdaNovo | 0.646 | 0.618 | 0.793 | 0.728 | 0.650 | 0.740 | 0.719 | 0.739 | 0.642 |
Papers describing it (7)
- De novo mass spectrometry peptide sequencing with a transformer model (2022, bioRxiv, preprint)
- De novo mass spectrometry peptide sequencing with a transformer model (2022, ICML 2022, ML conference)
- Sequence-to-sequence translation from mass spectra to peptides with a transformer model (2023, bioRxiv, preprint)
- Sequence-to-sequence translation from mass spectra to peptides with a transformer model (2024, Nature Communications, peer-reviewed)
- Accounting for Digestion Enzyme Bias in Casanovo (2024, Journal of Proteome Research, peer-reviewed)
- Improvements to CasaNovo, a deep learning de novo peptide sequencer (2025, bioRxiv, preprint)
- Improvements to Casanovo, a Deep Learning De Novo Peptide Sequencer (2025, Journal of Proteome Research, peer-reviewed)
Papers using it (12)
Applications and evaluations that ran this method. They are not counted among its authors below.
- PepPr: De Novo peptide sequencing with peptide priors (2026, bioRxiv, preprint)
- pXg: Comprehensive and Reliable Identification of MHC-I Antigens Using De Novo Peptide Sequencing and Immunotranscriptomic Datasets (2026, Methods in Molecular Biology, peer-reviewed)
- Beyond Best Guesses: A Multi-Level Confidence Assessment Framework for De Novo Peptide Sequencing Results (2026, HUPO 2026 World Congress, presentation)
- Can we Confidently Sequence the „Peptide Dark Matter“? Reaching a Consensus for De Novo Peptide Sequencing (2026, Proceedings of the 38th European Peptide Symposium, presentation)
- Spectra Fragment-Ion and Amino Acid Probability Prediction for Peptide Sequencing (2026, thesis)
- Reference-free protein sequencing by consensus assembly of redundant de novo peptide reads (2026, bioRxiv, preprint)
- Tandem Mass Spectra Representation Design for Transformer-Based De Novo Peptide Sequencing (2026, thesis)
- CasanovoGUI: a cross-platform desktop application for deep learning-based de novo peptide sequencing with Casanovo (2026, bioRxiv, preprint)
- Self-assembling proteins compose the chemically resistant shell biomaterial of planktonic tintinnid ciliates (2026, Nature Communications, peer-reviewed)
- NovoTax: prokaryotic strain identification from mass spectrometry-based proteomics data (2026, bioRxiv, preprint)
- Systematic benchmarking of mass spectrometry-based antibody sequencing reveals methodological biases (2025, Cell Systems, peer-reviewed)
- Systematic benchmarking of mass spectrometry-based antibody sequencing reveals methodological biases (2024, bioRxiv, preprint)