Direct determination of discrete harmonic bath parameters from molecular dynamics simulations
- 期刊名称Journal of Computational Chemistry
- 作者Walters, Peter L.; Allen, Thomas C.; Makri, Nancy
- 印刷ISSN0192-8651
- 文件大小423.09KB
- 发表时间2016-11
- DOI10.1002/jcc.24527
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