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Parallel ab initio and molecular mechanics investigation of polycoordinated Zn(II) complexes with model hard and soft ligands: Variations of binding energy and of its components with number and charges of ligands.

Gilles TiraboschiNohad GreshClaude Giessner-PrettreLee G. PedersenDavid W. Deerfield
Published in: J. Comput. Chem. (2000)
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