Molecular mechanics for zinc complexes with fluctuating atomic charges

Journal of Molecular Modeling

Volumn 7, Issue 4, 2001, Pages 54-64

  Sternberg, Ulrich ^a   Kock, Frank Thomas ^a   Bräuer, Michael ^a   Kunert, Michael ^a   Anders, Ernst ^a  

^a FRIEDRICH SCHILLER UNIVERSITY JENA   (Germany)

Author keywords

Bond distances; Calculation of atomic charges; Electrostatic interactions; Force field; Zinc complexes

Indexed keywords

LANTHANUM; LIGAND; ZINC COMPLEX;

ARTICLE; BINDING ASSAY; CHEMICAL BINDING; CHEMICAL INTERACTION; CHEMICAL PARAMETERS; CHEMICAL STRUCTURE; CONTROLLED STUDY; ELECTRIC ACTIVITY; MATHEMATICAL COMPUTING; METAL BINDING; MOLECULAR MECHANICS; MOLECULAR STABILITY; POLARIZATION; PRIORITY JOURNAL; QUANTUM CHEMISTRY; STRUCTURE ANALYSIS; X RAY ANALYSIS;

EID: 0035788952     PISSN: 16102940     EISSN: None     Source Type: Journal    
DOI: 10.1007/S008940100007     Document Type: Article

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