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Therapeutics Data Commons: Machine Learning Datasets and Tasks for Therapeutics., , , , , , , , , and . CoRR, (2021)Scientific discovery in the age of artificial intelligence., , , , , , , , , and 20 other author(s). Nat., 620 (7972): 47-60 (2023)PyTrial: A Comprehensive Platform for Artificial Intelligence for Drug Development., , , , and . CoRR, (2023)MolDesigner: Interactive Design of Efficacious Drugs with Deep Learning., , , , , , , , , and . CoRR, (2020)Antibody Complementarity Determining Regions (CDRs) design using Constrained Energy Model., and . KDD, page 389-399. ACM, (2022)Quasi-Newton Hamiltonian Monte Carlo., , and . UAI, AUAI Press, (2016)MIMOSA: Multi-constraint Molecule Sampling for Molecule Optimization., , , , and . AAAI, page 125-133. AAAI Press, (2021)DeepPurpose: a deep learning library for drug-target interaction prediction., , , , , and . Bioinform., 36 (22-23): 5545-5547 (2021)Multimodal Clinical Trial Outcome Prediction with Large Language Models., , , , , and . CoRR, (2024)MIMOSA: Multi-constraint Molecule Sampling for Molecule Optimization., , , , and . CoRR, (2020)