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))

Keywords:Machine Learning Potential, Long range interaction, multiscale method