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Solvation Free Energies from Machine Learning Molecular Dyn..:
Bonnet, Nicéphore
;
Marzari, Nicola
Journal of Chemical Theory and Computation. 20 (2024) 11 - p. 4820-4823 , 2024
Link:
https://doi.org/10.1021/acs.jctc.4c00116
RT Journal T1 <Title>Solvation Free Energies from Machine Learning Molecular Dynamics</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1021_acs.jctc.4c00116&Exemplar=1&LAN=DE A1 Bonnet, Nicéphore A1 Marzari, Nicola PB American Chemical Society (ACS) YR 2024 SN 1549-9618 SN 1549-9626 JF Journal of Chemical Theory and Computation VO 20 IS 11 SP 4820 OP 4823 LK http://dx.doi.org/https://doi.org/10.1021/acs.jctc.4c00116 DO https://doi.org/10.1021/acs.jctc.4c00116 SF ELIB - SuUB Bremen
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