[A1456-2pm] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

1:40 PM - 2:00 PM JST(4:40 AM - 5:00 AM UTC)Japanese

[A1456-2pm-03] PFP/MM: A Hybrid of a Universal Machine Learning Interatomic Potential and a Classical Force Field for Large-Scale Reactive Simulations

○Yu Miyazaki¹, Atsuhiro Tomita¹, Akihide Hayashi¹, Mizuki Takemoto¹, Hodaka Mori¹ (1. Preferred Networks, Inc.)

Keywords:

Machine Learning Interatomic Potential,Molecular Dynamics,Polymer,Metalloenzyme Reaction