Poster 1

[PS1-04] Learning QM/MM Potential by Equivariant Multiscale Model

*YaoKun Lei^1,2, Yagi Kiyoshi^1,2, Yuji Sugita^1,2 (1. Theoretical Molecular Science Laboratory, RIKEN Cluster for Pioneering Research (Japan), 2. Laboratory for Biomolecular Function Simulation, RIKEN Center for Biosystems Dynamics Research (Japan))

キーワード：Machine Learning Potential, Long range interaction, multiscale method