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Faster Molecular Dynamics with Neural Network Potentials via Distilled Multiple Time-Stepping and Non-Conservative Forces

Fuente: arXiv

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Bibliographic Details
Main Authors:	Gouraud, Nicolaï, Cattin, Côme, Plé, Thomas, Adjoua, Olivier, Lagardère, Louis, Piquemal, Jean-Philip
Format:	Preprint
Published:	2026
Subjects:	Chemical Physics Machine Learning
Online Access:	Acceder al recurso
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