Functional-Group-Based Diffusion for Pocket-Specific Molecule Generation and Elaboration

Haitao Lin, Yufei Huang, Odin Zhang, Yunfan Liu, Lirong Wu, Siyuan Li, Zhiyuan Chen 0008, Stan Z. Li. Functional-Group-Based Diffusion for Pocket-Specific Molecule Generation and Elaboration. In Alice Oh, Tristan Naumann, Amir Globerson, Kate Saenko, Moritz Hardt, Sergey Levine, editors, Advances in Neural Information Processing Systems 36: Annual Conference on Neural Information Processing Systems 2023, NeurIPS 2023, New Orleans, LA, USA, December 10 - 16, 2023. 2023. [doi]

Abstract

Abstract is missing.