“Thermodynamic Activation Parameters Calculated for Chorismate Mutase Reaction in Two Enzymes Using EVB/MD Free Energy Perturbation Calculations”

https://pubmed.ncbi.nlm.nih.gov/38112329

This study calculates thermodynamic activation parameters for the chorismate mutase reaction in two enzymes using EVB/MD free energy perturbation calculations, finding that the reactions are enthalpically driven with a more efficient catalysis in the monofunctional CM from B. subtilis.