Adapting the semi-explicit assembly solvation model for...

Journal of Computer-Aided Molecular Design 2016 / 11 Vol. 30; Iss. 11

Adapting the semi-explicit assembly solvation model for estimating water-cyclohexane partitioning with the SAMPL5 molecules

Brini, Emiliano, Paranahewage, S. Shanaka, Fennell, Christopher J., Dill, Ken A.
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Volume:
30
Language:
english
Journal:
Journal of Computer-Aided Molecular Design
DOI:
10.1007/s10822-016-9961-9
Date:
November, 2016
File:
PDF, 1.57 MB
english, 2016
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