COMPUTER SIMULATIONS WITH EXPLICIT SOLVENT: Recent Progress in the Thermodynamic Decomposition of Free Energies and in Modeling Electrostatic Effects
- 1 October 1998
- journal article
- review article
- Published by Annual Reviews in Annual Review of Physical Chemistry
- Vol. 49 (1), 531-567
- https://doi.org/10.1146/annurev.physchem.49.1.531
Abstract
▪ Abstract This review focuses on recent progress in two areas in which computer simulations with explicit solvent are being applied: the thermodynamic decomposition of free energies, and modeling ...Keywords
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