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Inclusion of the ligand field contribution in a polarizable molecular mechanics: SIBFA-LF.
J Comput Chem. 2003 Dec;24(16):1963-70. doi: 10.1002/jcc.10354.
J Comput Chem. 2003.
PMID: 14531050
DommiMOE: an implementation of ligand field molecular mechanics in the molecular operating environment.
Deeth RJ, Fey N, Williams-Hubbard B.
Deeth RJ, et al. Among authors: williams hubbard b.
J Comput Chem. 2005 Jan 30;26(2):123-30. doi: 10.1002/jcc.20137.
J Comput Chem. 2005.
PMID: 15584081
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