ListarReactividade Química e Fotorreactividade (REACT!) por tema "Ferryl oxygen"
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Common Reactivity and Properties of Heme Peroxidases: A DFT Study of Their Origin
(MDPI, 2023-01-28)[Abstract] Electronic structure calculations using the density-functional theory (DFT) have been performed to analyse the effect of water molecules and protonation on the heme group of peroxidases in different redox (ferric, ...