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Binding of 5-phospho-D-arabinonohydroxamate and 5-phospho-D-arabinonate inhibitors to zinc phosphomannose isomerase from ::::Candida albicans:::: studied by polarizable molecular mechanics and quantum mechanics

Celine Roux, Nohad Gresh, Lalith E. Perera, Jean-Philip Piquemal, Laurent Salmon. Binding of 5-phospho-D-arabinonohydroxamate and 5-phospho-D-arabinonate inhibitors to zinc phosphomannose isomerase from ::::Candida albicans:::: studied by polarizable molecular mechanics and quantum mechanics. Journal of Computational Chemistry, 28(5):938-957, 2007. [doi]

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