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[会议论文] 作者：J.Zhang,C.W.Liu,Y.Q.Gao,
来源：The 15th ICQC International Congress of Quantum Chemistry(第1 年份：2015
Many chemical reactions occur in solutions and it is important to understand how solvation affects their reaction mechanisms.QM/MM simulations serve as a powerf...
A new hybrid SITS/Metadynamics enhanced sampling method to study the selective C-H activation of tet
[会议论文] 作者：Y.I.Yang,Y.Q.Gao,L.Yang,J.Zhang,
来源：The 15th ICQC International Congress of Quantum Chemistry(第1 年份：2015
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A new hybrid SITS/Metadynamics enhanced sampling method to study the selective C-H activation of tet
[会议论文] 作者：Y.I.Yang,J.Zhang,L.Yang,Y.Q.Gao,
来源：The 15th ICQC International Congress of Quantum Chemistry(第1 年份：2015
We developed a new hybrid enhanced sampling method that combines the selective integrated tempering sampling(SITS)method [1] with the metadynamics method[2]....
[会议论文] 作者：C.Gu,J.Zhang,I.Y.Yang,X.Chen,Y.Q.Gao,
来源：The 15th ICQC International Congress of Quantum Chemistry(第1 年份：2015
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[会议论文] 作者：X.J.Huang,H.Y.Li,Y.Q.Gao,X.C.Wang,Z.C.Li,Y.S.Wu,T.Zhang,D.X.Chen,H.Wu,
来源：Second Ditan International Conference on Infectious Diseases 年份：2008
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