Performance of various models in structural characterization of n -butanol: Molecular dynamics and X-ray scattering studies

出版年份 2017 全文链接

标题

作者

关键词

GROMOS, CHARMM, OPLS, AMBER, TraPPE, Complemented system approach

出版物

Volume 229, Issue -, Pages 346-357

出版商

Elsevier BV

发表日期

2016-12-24

DOI

10.1016/j.molliq.2016.12.057

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