Estimation of rate constants in nonlinear reactions involving chemical inactivation of oxidation catalysts

• Published in: Journal of mathematical chemistry Vol. 52; no. 5; pp. 1460 - 1476
• Main Authors: Emelianenko, Maria, Torrejon, Diego, DeNardo, Matthew A., Socolofsky, Annika K., Ryabov, Alexander D., Collins, Terrence J.
• Format: Journal Article
• Language: English
• Published: Cham Springer International Publishing 01.05.2014
• Subjects: Chemistry; Chemistry and Materials Science; Math. Applications in Chemistry; Original Paper; Physical Chemistry; Theoretical and Computational Chemistry; Ordinary differential equations; Mathematical modeling; Hydrogen peroxide; Iron TAMLs; Perturbation methods; Catalyst inactivation

Over the last decades, copious work has been devoted to the development of small molecule replicas of the peroxidase enzymes that activate hydrogen peroxide in metabolic and detoxifying processes. TAML activators that are the subject of this study are the first full functional, small molecule peroxi...