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1 Ergebnisse
1
Exact Analytical Algorithm for the Solvent-Accessible Surfa..:
Cao, Xin
;
Hummel, Michelle H.
;
Wang, Yuzhang
..
Journal of Chemical Theory and Computation. 20 (2024) 11 - p. 4456-4468 , 2024
Link:
https://doi.org/10.1021/acs.jctc.3c01366
RT Journal T1 <Title>Exact Analytical Algorithm for the Solvent-Accessible Surface Area and Derivatives in Implicit Solvent Molecular Simulations on GPUs</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1021_acs.jctc.3c01366&Exemplar=1&LAN=DE A1 Cao, Xin A1 Hummel, Michelle H. A1 Wang, Yuzhang A1 Simmerling, Carlos A1 Coutsias, Evangelos A. 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 4456 OP 4468 LK http://dx.doi.org/https://doi.org/10.1021/acs.jctc.3c01366 DO https://doi.org/10.1021/acs.jctc.3c01366 SF ELIB - SuUB Bremen
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