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Published at November 26

P2DFlow: A Protein Ensemble Generative Model with SE(3) Flow Matching

physics.bio-ph
cs.LG

Released Date: November 26, 2024

Authors: Yaowei Jin1, Qi Huang2, Ziyang Song3, Mingyue Zheng4, Dan Teng4, Qian Shi1

Aff.: 1Lingang Laboratory, Shanghai 200031, China; 2Institute for Electric Light Sources, School of Information Science and Technology, Fudan University, Shanghai 200438, P. R. China; 3Shanghai Key Lab of Chemical Assessment and Sustainability, School of Chemical Science and Engineering, Tongji University, Shanghai 200092, P. R. China; 4Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, 555 Zuchongzhi Road, Shanghai 201203, China

Arxiv: http://arxiv.org/abs/2411.17196v1