"protein-ligand binding" Papers
3 papers found
Interaction-based Retrieval-augmented Diffusion Models for Protein-specific 3D Molecule Generation
Zhilin Huang, Ling Yang, Xiangxin Zhou et al.
ICML 2024poster
Re-Dock: Towards Flexible and Realistic Molecular Docking with Diffusion Bridge
Yufei Huang, Odin Zhang, Lirong Wu et al.
ICML 2024spotlight
Structure-based drug design by denoising voxel grids
Pedro O. Pinheiro, Arian Jamasb, Omar Mahmood et al.
ICML 2024poster