SAnDReS 2.0: Development of machine-learning models to explore the scoring function space.

Walter Filgueira de Azevedo Jr. Rodrigo Quiroga Marcos Ariel Villarreal Nelson José Freitas da Silveira Gabriela Bitencourt-Ferreira Amauri Duarte da Silva Martina Veit-Acosta Patricia Rufino Oliveira Marco Tutone Nadezhda Yu. Biziukova Vladimir Poroikov Olga A. Tarasova Stéphanie Baud SAnDReS 2.0: Development of machine-learning models to explore the scoring function space. 2333-2346 2024 45 J. Comput. Chem. 27, October https://doi.org/10.1002/jcc.27449 db/journals/jcc/jcc45.html#AzevedoQVSBSVOTBPTB24 streams/journals/jcc