"A Small Step Toward Generalizability: Training a Machine Learning Scoring ..."

Jack Scantlebury et al. (2023)

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DOI: 10.1021/ACS.JCIM.3C00322

access: closed

type: Journal Article

metadata version: 2024-10-06

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  - https://dblp.org/rec/journals/jcisd/ScantleburyVCHTBCDGDD23
Jack Scantlebury, Lucy Vost, Anna Carbery, Thomas E. Hadfield, Oliver M. Turnbull, Nathan Brown, Vijil Chenthamarakshan, Payel Das, Harold Grosjean, Frank von Delft, Charlotte M. Deane:
A Small Step Toward Generalizability: Training a Machine Learning Scoring Function for Structure-Based Virtual Screening. J. Chem. Inf. Model. 63(10): 2960-2974 (2023)

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