Multiscale Modeling of Thiol Overoxidation in Peroxiredoxins by Hydrogen Peroxide.

Semelak, J A

Multiscale Modeling of Thiol Overoxidation in Peroxiredoxins by Hydrogen Peroxide. [electronic resource] - Journal of chemical information and modeling 02 2020 - 843-853 p. digital

Publication Type: Journal Article; Research Support, Non-U.S. Gov't

1549-960X

10.1021/acs.jcim.9b00817 doi


Hydrogen Peroxide--metabolism
Molecular Dynamics Simulation
Mycobacterium tuberculosis--enzymology
Oxidation-Reduction
Peroxiredoxins--chemistry
Protein Conformation
Sulfhydryl Compounds--metabolism
Thermodynamics