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Protonation states of intermediates in the reaction mechanism of [NiFe] hydrogenase studied by computational methods

EngineeringBiochemistryHydrogen TransitionNatural SciencesEnzyme CatalysisReaction MechanismProton TransferMolecular BiologyProtonation StatesStructure-function Enzyme KineticsComputational ChemistryCatalysisChemistryQuantum ChemistryHydrogenComputational MethodsReaction Intermediate