[ASAP] Molecular Assays Simulator to Unravel Predictors Hacking in Goal-Directed Molecular Generations

Journal of Chemical Information and ModelingDOI: 10.1021/acs.jcim.3c00195

Source: Journal of Chemical Information and Modeling - June 22, 2023 Category: Chemistry Authors: Philippe Gendreau, Joseph-Andre ́ Turk, Nicolas Drizard, Vinicius Barros Ribeiro da Silva, Clarisse Descamps, and Yann Gaston-Mathé Source Type: research