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2020 – today
- 2024
[c1]Michal Koziarski, Andrei Rekesh, Dmytro Shevchuk, Almer van der Sloot, Piotr Gainski, Yoshua Bengio, Cheng-Hao Liu, Mike Tyers, Robert A. Batey:
RGFN: Synthesizable Molecular Generation Using GFlowNets. NeurIPS 2024- [i5]Michal Koziarski, Mohammed Abukalam, Vedant Shah, Louis Vaillancourt, Doris Alexandra Schuetz, Moksh Jain, Almer van der Sloot
, Mathieu Bourgey, Anne Marinier, Yoshua Bengio:
Towards DNA-Encoded Library Generation with GFlowNets. CoRR abs/2404.10094 (2024) - [i4]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, Sai Krishna Gottipati, Priyesh Vijayan, Prateek Gupta, Ladislav Rampásek, Sasikanth Avancha, Pierre-Luc Bacon, William L. Hamilton, Brooks Paige, Sanchit Misra, Stanislaw Kamil Jastrzebski, Bharat Kaul, Doina Precup, José Miguel Hernández-Lobato, Marwin H. S. Segler, Michael M. Bronstein, Anne Marinier, Mike Tyers, Yoshua Bengio:
Generative Active Learning for the Search of Small-molecule Protein Binders. CoRR abs/2405.01616 (2024) - [i3]Michal Koziarski, Andrei Rekesh, Dmytro Shevchuk, Almer van der Sloot, Piotr Gainski, Yoshua Bengio, Cheng-Hao Liu, Mike Tyers, Robert A. Batey:
RGFN: Synthesizable Molecular Generation Using GFlowNets. CoRR abs/2406.08506 (2024) - 2022
- [i2]Paul Bertin, Jarrid Rector-Brooks, Deepak Sharma, Thomas Gaudelet, Andrew Anighoro, Torsten Gross, Francisco Martinez-Pena, Eileen L. Tang, Suraj M. S, Cristian Regep, Jeremy B. R. Hayter, Maksym Korablyov, Nicholas Valiante, Almer van der Sloot, Mike Tyers, Charles Roberts, Michael M. Bronstein, Luke L. Lairson, Jake P. Taylor-King, Yoshua Bengio:
RECOVER: sequential model optimization platform for combination drug repurposing identifies novel synergistic compounds in vitro. CoRR abs/2202.04202 (2022) - [i1]Bonaventure F. P. Dossou, Dianbo Liu, Xu Ji, Moksh Jain, Almer M. van der Sloot, Roger Palou, Michael Tyers, Yoshua Bengio:
Graph-Based Active Machine Learning Method for Diverse and Novel Antimicrobial Peptides Generation and Selection. CoRR abs/2209.13518 (2022)
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