Efficiency and Accuracy of the Generalized Solvent Boundary Potential for Hybrid QM/MM Simulations: Implementation for Semiempirical Hamiltonians

标题
Efficiency and Accuracy of the Generalized Solvent Boundary Potential for Hybrid QM/MM Simulations: Implementation for Semiempirical Hamiltonians
作者
关键词
-
出版物
Journal of Chemical Theory and Computation
Volume 4, Issue 10, Pages 1600-1609
出版商
American Chemical Society (ACS)
发表日期
2008-09-19
DOI
10.1021/ct800193a

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