Combined Electrostatically Embedded Multiconfiguration Molecular Mechanics and Molecular Mechanical Method: Application to Molecular Dynamics Simulation of a Chemical Reaction in Aqueous Solution with Hybrid Density Functional Theory
2008 ◽
Vol 4
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pp. 1032-1039
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2019 ◽
Vol 38
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pp. 4325-4335
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1999 ◽
Vol 111
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pp. 1117-1125
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2020 ◽
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pp. 024119
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pp. 11723-11733
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pp. 409-417
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pp. 244108
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