Universal Solvation Models

Author:

Hawkins Gregory D.1,Zhu Tianhai1,Li Jiabo1,Chambers Candee C.12,Giesen David J.13,Liotard Daniel A.4,Cramer Christopher J.1,Truhlar Donald G.1

Affiliation:

1. Department of Chemistry and Supercomputer Institute, University of Minnesota, Minneapolis, MN 55455

2. Current address: Departments of Chemistry and Physics, Mercyhurst College, 501 East 38th Street, Erie, PA 16546

3. Eastman Kodak Company, Rochester, NY 14650

4. Laboratoire de Physico-Chimie Theorique, Universite de Bordeaux 1, 351 Cours de la Liberation, 33405 Talence Cedex, France

Publisher

American Chemical Society

Cited by 18 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献

1. Quantum Mechanical Continuum Solvation Models for Ionic Liquids;The Journal of Physical Chemistry B;2012-07-13

2. Prediction of SAMPL2 aqueous solvation free energies and tautomeric ratios using the SM8, SM8AD, and SMD solvation models;Journal of Computer-Aided Molecular Design;2010-04

3. Unraveling the Mechanisms of Ribozyme Catalysis with Multiscale Simulations;Challenges and Advances in Computational Chemistry and Physics;2009

4. Modeling Free Energies of Solvation in Olive Oil;Molecular Pharmaceutics;2008-10-17

5. VBSM: A Solvation Model Based on Valence Bond Theory;The Journal of Physical Chemistry A;2008-08-01

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