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1 Ergebnisse
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Tinker‐OpenMM: Absolute and relative alchemical free energi..:
Harger, Matthew
;
Li, Daniel
;
Wang, Zhi
...
Journal of Computational Chemistry. 38 (2017) 23 - p. 2047-2055 , 2017
Link:
https://doi.org/10.1002/jcc.24853
RT Journal T1 <Title>Tinker‐OpenMM: Absolute and relative alchemical free energies using AMOEBA on GPUs</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1002_jcc.24853&Exemplar=1&LAN=DE A1 Harger, Matthew A1 Li, Daniel A1 Wang, Zhi A1 Dalby, Kevin A1 Lagardère, Louis A1 Piquemal, Jean‐Philip A1 Ponder, Jay A1 Ren, Pengyu PB Wiley YR 2017 SN 0192-8651 SN 1096-987X JF Journal of Computational Chemistry VO 38 IS 23 SP 2047 OP 2055 LK http://dx.doi.org/https://doi.org/10.1002/jcc.24853 DO https://doi.org/10.1002/jcc.24853 SF ELIB - SuUB Bremen
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