Computational Modeling of the Enzymatic Achmatowicz Rearrangement by Heme-Dependent Chloroperoxidase: Reaction Mechanism, Enantiopreference, Regioselectivity, and Substrate Specificity. - Fuqiang Chen; Chenghua Zhang; Shiqing Zhang; Wuyuan Zhang; Hao Su; Xiang Sheng (J. Chem. Inf. Model., 2025)