F. Maseras and K. Morokuma, “IMOMM – A new integrated ab-initio plus molecular mechanics geometry optimization scheme of equilibrium structures and transition-states,” J. Comp. Chem., 16 (1995) 1170-79. DOI: 10.1002/jcc.540160911
F. Maseras and K. Morokuma, “IMOMM – A new integrated ab-initio plus molecular mechanics geometry optimization scheme of equilibrium structures and transition-states,” J. Comp. Chem., 16 (1995) 1170-79. DOI: 10.1002/jcc.540160911
