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1 Ergebnisse
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A Comparison of QM/MM Simulations with and without the Drud..:
König, Gerhard
;
Pickard, Frank
;
Huang, Jing
...
Molecules. 23 (2018) 10 - p. 2695 , 2018
Link:
https://doi.org/10.3390/molecules23102695
RT Journal T1
A Comparison of QM/MM Simulations with and without the Drude Oscillator Model Based on Hydration Free Energies of Simple Solutes
UL https://suche.suub.uni-bremen.de/peid=cr-10.3390_molecules23102695&Exemplar=1&LAN=DE A1 König, Gerhard A1 Pickard, Frank A1 Huang, Jing A1 Thiel, Walter A1 MacKerell, Alexander A1 Brooks, Bernard A1 York, Darrin PB MDPI AG YR 2018 SN 1420-3049 JF Molecules VO 23 IS 10 SP 2695 LK http://dx.doi.org/https://doi.org/10.3390/molecules23102695 DO https://doi.org/10.3390/molecules23102695 SF ELIB - SuUB Bremen
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