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1 Ergebnisse
1
MoleGuLAR: Molecule Generation Using Reinforcement Learning..:
Manan Goel (11796623)
;
Shampa Raghunathan (1736623)
;
Siddhartha Laghuvarapu (11796626)
.
https://figshare.com/articles/journal_contribution/MoleGuLAR_Molecule_Generation_Using_Reinforcement_Learning_with_Alternating_Rewards/17129063. , 1753
Link:
https://doi.org/10.1021/acs.jcim.1c01341.s001
RT Journal T1
MoleGuLAR: Molecule Generation Using Reinforcement Learning with Alternating Rewards
UL https://suche.suub.uni-bremen.de/peid=base-ftsmithonian:oai:figshare.com:article_17129063&Exemplar=1&LAN=DE A1 Manan Goel (11796623) A1 Shampa Raghunathan (1736623) A1 Siddhartha Laghuvarapu (11796626) A1 U. Deva Priyakumar (480753) YR 1753 K1 Biochemistry K1 Genetics K1 Molecular Biology K1 Pharmacology K1 Biotechnology K1 Cancer K1 Biological Sciences not elsewhere classified K1 Chemical Sciences not elsewhere classified K1 Information Systems not elsewhere classified K1 significantly higher number K1 important problem especially K1 finding possible matches K1 existing data sets K1 de novo generation K1 start generating molecules K1 high binding affinities K1 generate druglike molecules K1 binding affinity K1 weighted sum K1 strategy shows K1 specified target K1 quantitative estimate K1 novel targets K1 novel strategy K1 new inhibitors K1 multiobjective optimization K1 enhanced ability K1 drug likeliness K1 desirable properties K1 current scenario K1 conventional approaches K1 conventional approach K1 computational strategy K1 changed periodically JF https://figshare.com/articles/journal_contribution/MoleGuLAR_Molecule_Generation_Using_Reinforcement_Learning_with_Alternating_Rewards/17129063 LK http://dx.doi.org/https://doi.org/10.1021/acs.jcim.1c01341.s001 DO https://doi.org/10.1021/acs.jcim.1c01341.s001 SF ELIB - SuUB Bremen
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