Revealing Monoamine Oxidase B Catalytic Mechanisms by Means of the Quantum Chemical Cluster Approach

Two of the possible catalytic mechanisms for neurotransmitter oxidative deamination by monoamine oxidase B (MAO B), namely, polar nucleophilic and hydride transfer, were addressed in order to comprehend the nature of their rate-determining step. The Quantum Chemical Cluster Approach was used to obta...

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Veröffentlicht in:Journal of chemical information and modeling 2015-07, Vol.55 (7), p.1349-1360
Hauptverfasser: Zapata-Torres, Gerald, Fierro, Angélica, Barriga-González, German, Salgado, J. Cristian, Celis-Barros, Cristian
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Sprache:eng
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