Optimized GPU implementation of Merck Molecular Force Field and Universal Force Field

出版年份 2019 全文链接

标题

作者

关键词

Molecular mechanics, Merck Molecular Force Field (MMFF94), Universal Force Field (UFF), Graphics processing unit (GPU), Materials science

出版物

Volume 1188, Issue -, Pages 227-233

出版商

Elsevier BV

发表日期

2019-04-04

DOI

10.1016/j.molstruc.2019.04.007

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