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Optimizing the Accuracy and Efficiency of Fast Hierarchical Multipole Expansions for MD Simulations

Lorenzen, Konstantin; Schwörer, Magnus; Tröster, Philipp; Mates, Simon; Tavan, Paul

期刊名称Journal of Chemical Theory and Computation
作者Lorenzen, Konstantin; Schwörer, Magnus; Tröster, Philipp; Mates, Simon; Tavan, Paul
卷第8卷
期第10期
印刷ISSN1549-9618
电子ISSN1549-9626
文件大小862.44KB
发表时间2012-10-09
DOI10.1021/ct300080n
页码3628-3636