Scaling Neural-Network-Based Molecular Dynamics with Long-Range Electrostatic Interactions to 51 Nanoseconds per Day

Fuente: arXiv
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Bibliographic Details
Main Authors: Li, Jianxiong, Zhang, Beining, Li, Mingzhen, Hu, Siyu, Zeng, Jinzhe, Liu, Lijun, Yuan, Guojun, Wang, Zhan, Tan, Guangming, Jia, Weile
Format: Preprint
Published: 2025
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