Neural Network Potential with Multi-Resolution Approach Enables Accurate Prediction of Reaction Free Energies in Solution

Fuente: arXiv

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Bibliographic Details
Main Authors:	Pultar, Felix, Thuerlemann, Moritz, Gordiy, Igor, Doloszeski, Eva, Riniker, Sereina
Format:	Preprint
Published:	2024
Subjects:	Chemical Physics
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2411.19728