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1 Ergebnisse
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Accurate prediction of hydration free energies and solvatio..:
Borgis, Daniel
;
Luukkonen, Sohvi
;
Belloni, Luc
.
info:eu-repo/semantics/altIdentifier/doi/10.1063/5.0057506. , 2021
Link:
https://hal.science/hal-03454131
RT Journal T1
Accurate prediction of hydration free energies and solvation structures using molecular density functional theory with a simple bridge functional
UL https://suche.suub.uni-bremen.de/peid=base-ftunigrenoble:oai:HAL:hal-03454131v1&Exemplar=1&LAN=DE A1 Borgis, Daniel A1 Luukkonen, Sohvi A1 Belloni, Luc A1 Jeanmairet, Guillaume PB HAL CCSD; American Institute of Physics YR 2021 K1 [CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry JF info:eu-repo/semantics/altIdentifier/doi/10.1063/5.0057506 LK http://dx.doi.org/https://hal.science/hal-03454131 DO https://hal.science/hal-03454131 SF ELIB - SuUB Bremen
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