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A Minimal Implementation of the AMBER-PAICS Interface for Ab Initio FMO-QM/MM-MD Simulation

A Minimal Implementation of the AMBER-PAICS Interface for Ab Initio FMO-QM/MM-MD Simulation

Okamoto, Takuya; Ishikawa, Takeshi; Koyano, Yoshiyuki; Yamamoto, Norifumi; Kuwata, Kazuo; Nagaoka, Masataka
  • 期刊名称Bulletin of the Chemical Society of Japan
  • 作者Okamoto, Takuya; Ishikawa, Takeshi; Koyano, Yoshiyuki; Yamamoto, Norifumi; Kuwata, Kazuo; Nagaoka, Masataka
  • 卷第86卷
  • 期第2期
  • 印刷ISSN0009-2673
  • 电子ISSN1348-0634
  • 文件大小3246.03KB
  • 发表时间2013-02-15
  • DOI10.1246/bcsj.20120216
  • 页码210-222
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