Binding of D- and L-captopril inhibitors to metallo–lactamase studied by polarizable molecular mechanics and quantum mechanics. - Jens Antony; Nohad Gresh; Lars Olsen; Lars Hemmingsen; Christopher J. Schofield; Rogert Bauer (J. Comput. Chem., 2002)

Complexes of thiomandelate and captopril mercaptocarboxylate inhibitors to metallo-lactamase by polarizable molecular mechanics. Validation on model binding sites by quantum chemistry. - Jens Antony; Jean-Philip Piquemal; Nohad Gresh (J. Comput. Chem., 2005)

Fully ab initio protein-ligand interaction energies with dispersion corrected density functional theory. - Jens Antony; Stefan Grimme (J. Comput. Chem., 2012)