Catalysis on the coastline: Theozyme, molecular dynamics, and free energy perturbation analysis of antibody 21D8 catalysis of the decarboxylation of 5-nitro-3-carboxybenzisoxazole.
Gregori UjaqueDean J. TantilloYunfeng HuK. N. HoukKinya HottaDonald HilvertPublished in: J. Comput. Chem. (2003)