DiffBP: Generative Diffusion of 3D Molecules for Target Protein Binding.

Haitao Lin Yufei Huang Meng Liu Xuanjing Li Shuiwang Ji Stan Z. Li

Published in: CoRR (2022)

Keyphrases

molecular structures
dna binding
virtual screening
generative model
chemical compounds
protein structure
anisotropic diffusion
chemical reactions
amino acids
fine grained
augmented reality
protein sequences
computational methods
diffusion model