Predicting solvation free energies with an implicit solvent machine learning potential

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Authors: Sebastien Röcken, Anton F. Burnet, Julija Zavadlav

Journal title: The Journal of Chemical Physics

Journal number: 161

Journal publisher: AIP Publishing

Published year: 2024

DOI identifier: 10.1063/5.0235189

ISSN: 0021-9606