Search
CSV
RISComputational Modeling of Glutathione Peroxidase Mimic in Hydrogen Peroxide Reduction at Various Temperatures
Year: 2019
Abstract:
The development of enzyme mimics has been rapidly increased, recently. Herein, the studies on the
mechanism of oxidation reaction of GPx mimic in the presence of hydrogen peroxide were evaluated by using the 6-31+G(d,p) ...
Solvent Effects on the Reduction of Hydrogen Peroxide in the presence of Glutathione Peroxidase Mimic, Molecular Approach
Year: 2019
Abstract:
The mechanism of reduction of the hydrogen peroxide by glutathione peroxidase mimic (GPx) were
investigated by density functional theory (DFT) method at the M06-2X/6-31+G(d,p) level of theory. Thermodynamic and kinetic ...