Joint quantum chemical and polarizable molecular mechanics investigation of formate complexes with penta- and hexahydrated Zn2+: Comparison between energetics of model bidentate, monodentate, and through-water Zn2+ binding modes and evaluation of nonaddit - researchr publication authors

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Gilles Tiraboschi, Bernard-Pierre Roques, Nohad Gresh. Joint quantum chemical and polarizable molecular mechanics investigation of formate complexes with penta- and hexahydrated Zn2+: Comparison between energetics of model bidentate, monodentate, and through-water Zn2+ binding modes and evaluation of nonaddit. Journal of Computational Chemistry, 20(13):1379-1390, 1999. [doi]

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