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1 Ergebnisse
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Insights and Challenges in Correcting Force Field Based Sol..:
Karwounopoulos, Johannes
;
Wu, Zhiyi
;
Tkaczyk, Sara
...
The Journal of Physical Chemistry B. 128 (2024) 28 - p. 6693-6703 , 2024
Link:
https://doi.org/10.1021/acs.jpcb.4c01417
RT Journal T1
Insights and Challenges in Correcting Force Field Based Solvation Free Energies Using a Neural Network Potential
UL https://suche.suub.uni-bremen.de/peid=cr-10.1021_acs.jpcb.4c01417&Exemplar=1&LAN=DE A1 Karwounopoulos, Johannes A1 Wu, Zhiyi A1 Tkaczyk, Sara A1 Wang, Shuzhe A1 Baskerville, Adam A1 Ranasinghe, Kavindri A1 Langer, Thierry A1 Wood, Geoffrey P. F. A1 Wieder, Marcus A1 Boresch, Stefan PB American Chemical Society (ACS) YR 2024 SN 1520-6106 SN 1520-5207 JF The Journal of Physical Chemistry B VO 128 IS 28 SP 6693 OP 6703 LK http://dx.doi.org/https://doi.org/10.1021/acs.jpcb.4c01417 DO https://doi.org/10.1021/acs.jpcb.4c01417 SF ELIB - SuUB Bremen
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