Generative Active Learning for the Search of Small-molecule Protein Binders
Maksym Korablyov,Cheng-Hao Liu,Moksh Jain,Almer M. van der Sloot, Eric Jolicoeur,Edward Ruediger,Andrei Cristian Nica,Emmanuel Bengio, Kostiantyn Lapchevskyi,Daniel St-Cyr,Doris Alexandra Schuetz,Victor Ion Butoi,Jarrid Rector-Brooks,Simon Blackburn,Leo Feng,Hadi Nekoei, SaiKrishna Gottipati,Priyesh Vijayan,Prateek Gupta,Ladislav Rampášek,Sasikanth Avancha,Pierre-Luc Bacon,William L. Hamilton,Brooks Paige,Sanchit Misra,Stanislaw Kamil Jastrzebski,Bharat Kaul,Doina Precup,José Miguel Hernández-Lobato,Marwin Segler,Michael Bronstein,Anne Marinier,Mike Tyers,Yoshua Bengio arXiv (Cornell University)（2024）
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