Data for 'Accounting for digestion enzyme bias in Casanovo' (Melendez et al., 2024)

Source
Zenodo, 2024,
Author(s)
    Carlo Melendez, Justin Sanders, Melih Yilmaz, Wout Bittremieux, William E. Fondrie, Sewoong Oh, William Stafford Noble

Accounting for digestion enzyme bias in Casanovo

Source
Journal of proteome research - ISSN 1535-3893-23:10 (2024) p. 4761-4769
Author(s)
    Carlo Melendez, Justin Sanders, Melih Yilmaz, Wout Bittremieux, William E. Fondrie, Sewoong Oh, William Stafford Noble

Reusability report : annotating metabolite mass spectra with domain-inspired chemical formula transformers

Source
Nature Machine Intelligence - ISSN 2522-5839- (2024) p.

Library of Two Million Unique Small Molecules with Precalculated Fingerprints, Descriptors, and Cardiotoxicity Inhibition Data

Source
Zenodo, 2024,
Author(s)