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1 Ergebnisse
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Molecular Dynamics with Very Large Time Steps for the Calcu..:
Abreu, Charlles R. A.
;
Tuckerman, Mark E.
Journal of Chemical Theory and Computation. 16 (2020) 12 - p. 7314-7327 , 2020
Link:
https://doi.org/10.1021/acs.jctc.0c00698
RT Journal T1 <Title>Molecular Dynamics with Very Large Time Steps for the Calculation of Solvation Free Energies</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1021_acs.jctc.0c00698&Exemplar=1&LAN=DE A1 Abreu, Charlles R. A. A1 Tuckerman, Mark E. PB American Chemical Society (ACS) YR 2020 SN 1549-9618 SN 1549-9626 JF Journal of Chemical Theory and Computation VO 16 IS 12 SP 7314 OP 7327 LK http://dx.doi.org/https://doi.org/10.1021/acs.jctc.0c00698 DO https://doi.org/10.1021/acs.jctc.0c00698 SF ELIB - SuUB Bremen
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