Description of Potential Energy Surfaces of Molecules using FFLUX Machine Learning Models

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2019Keyword
MoleculesPotential energy surfaces
FFLUX model
Force-fields
Molecular modelling
Machine learning
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This document is the Accepted Manuscript version of a Published Work that appeared in final form in the Journal of Chemical Theory and Computation, copyright © American Chemical Society, after peer review and technical editing by the publisher. To access the final edited and published work see https://pubs.acs.org/doi/10.1021/acs.jctc.8b00806Peer-Reviewed
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