Learning
Set of papers shared by Adriano regarding ML approaches and MSMS
- https://www.nature.com/articles/s42256-023-00663-z
- https://doi.org/10.1021/jasms.3c00089
- https://doi.org/10.1021/jasms.3c00090
- https://arxiv.org/pdf/2111.04824.pdf
- https://doi.org/10.1101/2023.06.01.543126
- https://doi.org/10.1038/s42004-023-00932-3
- https://doi.org/10.1021/acs.analchem.3c02413
- https://doi.org/10.26434/chemrxiv-2023-vsmpx-v4
- https://doi.org/10.1186/s13321-024-00804-5
- https://arxiv.org/abs/2304.13136
- https://doi.org/10.26434/chemrxiv-2024-w0wvl
- https://doi.org/10.26434/chemrxiv-2024-k06gb
- https://doi.org/10.1038/s42004-024-01112-7
- https://doi.org/10.26434/chemrxiv-2023-kss3r
- https://doi.org/10.1038/s42256-024-00816-8
- https://doi.org/10.48550/arXiv.2404.02360
- https://doi.org/10.1101/2024.04.22.590551
- https://doi.org/10.1021/acs.jproteome.3c00857
- https://chemrxiv.org/engage/api-gateway/chemrxiv/assets/orp/resource/item/6646443621291e5d1d72fa6b/original/universal-fragmentation-model-for-tandem-mass-spectrometry-based-molecular-structural-elucidation.pdf
- https://doi.org/10.26434/chemrxiv-2024-k06gb-v3
- https://chemrxiv.org/engage/chemrxiv/article-details/64f76a0279853bbd7829bf27
- https://doi.org/10.1186/s13321-024-00905-1
- https://doi.org/10.1021/acs.analchem.4c02426
- https://doi.org/10.1021/acs.analchem.4c03724
Comparison of Cosine, Modified Cosine, and Neutral Loss Based Spectrum Alignment For Discovery of Structurally Related Molecules
https://doi.org/10.1021/jasms.2c00153
Spectral entropy outperforms MS/MS dot product similarity for small-molecule compound identification
https://doi.org/10.1038/s41592-021-01331-z