Characterizing Uncertainty in Machine Learning for Chemistry

TitleCharacterizing Uncertainty in Machine Learning for Chemistry
Publication TypeJournal Article
Year of Publication2023
AuthorsHeid E, McGill CJ, Vermeire FH, Green WH
JournalJournal of Chemical Information and Modeling
Volume63
Issue13
Pagination4012 - 4029
Date Published2023/07/10
ISBN Number1549-9596
URLhttps://doi.org/10.1021/acs.jcim.3c00373
Short TitleJ. Chem. Inf. Model.