Manganese peroxidase mediated oxidation of sulfamethoxazole: Integrating the computational analysis to reveal the reaction kinetics, mechanistic insights, and oxidation pathway

Title
Manganese peroxidase mediated oxidation of sulfamethoxazole: Integrating the computational analysis to reveal the reaction kinetics, mechanistic insights, and oxidation pathway
Authors
Keywords
Manganese peroxidase, DFT calculations, Catalytic mechanism, Oxidation pathway, Single-electron transfer mechanism
Journal
JOURNAL OF HAZARDOUS MATERIALS
Volume 415, Issue -, Pages 125719
Publisher
Elsevier BV
Online
2021-03-23
DOI
10.1016/j.jhazmat.2021.125719

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