A 3D Generative Model for Structure-Based Drug Design

von Luo, Shitong
Veröffentlicht in NeurIPS (35. : 2021 : Online) 35th Conference on Neural Information Processing Systems (NeurIPS 2021) ; Volume 8 of 36 (2022)

LEARNING GRADIENT FIELDS FOR MOLECULAR CONFORMATION GENERATION

von SHI, CHENCE
Veröffentlicht in International Conference on Machine Learning (38. : 2021 : Online) International Conference on Machine Learning (ICML 2021 ; Part 12 of 16 (2022)

Predicting Molecular Conformation via Dynamic Graph Score Matching

von Luo, Shitong
Veröffentlicht in NeurIPS (35. : 2021 : Online) 35th Conference on Neural Information Processing Systems (NeurIPS 2021) ; Volume 24 of 36 (2022)

Antigen-Specific Antibody Design and Optimization with Diffusion-Based Generative Models for Protein Structures

von Luo, Shitong
Veröffentlicht in NeurIPS (36. : 2022 : New Orleans, La.; Online) 36th Conference on Neural Information Processing Systems (NeurIPS 2022 ; Volume 13 of 50 (2023)

AN END-TO-END FRAMEWORK FOR MOLECULAR CONFORMATION GENERATION VIA BILEVEL PROGRAMMING

von XU, MINKAI
Veröffentlicht in International Conference on Machine Learning (38. : 2021 : Online) International Conference on Machine Learning (ICML 2021 ; Part 15 of 16 (2022)