The following publications are possibly variants of this publication:
- Complexes of a Zn-metalloenzyme binding site with hydroxamate-containing ligands. A case for detailed benchmarkings of polarizable molecular mechanics/dynamics potentials when the experimental binding structure is unknownNohad Gresh, David Perahia, Benoit de Courcy, Johanna Foret, Celine Roux, Lea El-Khoury, Jean-Philip Piquemal, Laurent Salmon. jcc, 37(32):2770-2782, 2016. [doi]
- Complexes of thiomandelate and captopril mercaptocarboxylate inhibitors to metallo-lactamase by polarizable molecular mechanics. Validation on model binding sites by quantum chemistryJens Antony, Jean-Philip Piquemal, Nohad Gresh. jcc, 26(11):1131-1147, 2005. [doi]