Presentation Information
[PS1-04]Learning QM/MM Potential by Equivariant Multiscale Model
*YaoKun Lei1,2, Yagi Kiyoshi1,2, Yuji Sugita1,2 (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
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