Accurate Conformation Sampling via Protein Structural Diffusion
Jiahao Fan, Ziyao Li, Eric Alcaide, Guolin Ke, Huaqing Huang, E Weinan
UFConf improves protein conformation sampling using a diffusion model based on amino acid sequences, outperforming existing methods and showing utility in drug discovery.
Journal of Chemical Information and Modeling · Sep 28, 2024Peer-reviewedBioinformatics