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Gusev, Filipp, Gutkin, Evgeny, Kurnikova, Maria G., Isayev, Olexandr (2023) Active Learning Guided Drug Design Lead Optimization Based on Relative Binding Free Energy Modeling. Journal of Chemical Information and Modeling, 63 (2) 583-594 doi:10.1021/acs.jcim.2c01052

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Reference TypeJournal (article/letter/editorial)
TitleActive Learning Guided Drug Design Lead Optimization Based on Relative Binding Free Energy Modeling
JournalJournal of Chemical Information and Modeling
AuthorsGusev, FilippAuthor
Gutkin, EvgenyAuthor
Kurnikova, Maria G.Author
Isayev, OlexandrAuthor
Year2023 (January 23)Volume63
Issue2
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/acs.jcim.2c01052Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID15679544Long-form Identifiermindat:1:5:15679544:1
GUID0
Full ReferenceGusev, Filipp, Gutkin, Evgeny, Kurnikova, Maria G., Isayev, Olexandr (2023) Active Learning Guided Drug Design Lead Optimization Based on Relative Binding Free Energy Modeling. Journal of Chemical Information and Modeling, 63 (2) 583-594 doi:10.1021/acs.jcim.2c01052
Plain TextGusev, Filipp, Gutkin, Evgeny, Kurnikova, Maria G., Isayev, Olexandr (2023) Active Learning Guided Drug Design Lead Optimization Based on Relative Binding Free Energy Modeling. Journal of Chemical Information and Modeling, 63 (2) 583-594 doi:10.1021/acs.jcim.2c01052
In(2023, January) Journal of Chemical Information and Modeling Vol. 63 (2) American Chemical Society (ACS)

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