Effect of metal Ions (Ni 2+, Cu 2+ and Zn 2+) and water coordination on the structure of L-phenylalanine, L-tyrosine, L-tryptophan and their zwitterionic forms

Journal of Molecular Modeling

Volumn 17, Issue 12, 2011, Pages 3117-3128

  Remko, Milan ^a   Fitz, Daniel ^b   Broer, Ria ^c   Rode, Bernd Michael ^b  

^a Faculty of Natural Sciences   (Slovakia)

^b UNIVERSITY OF INNSBRUCK   (Austria)

^c UNIVERSITY OF GRONINGEN   (Netherlands)

Author keywords

Aromatic amino acids; Complexes involving the transition metals Ni 2+ Cu 2+ and Zn 2+; DFT calculations; Molecular structure; Solvent effect

Indexed keywords

COPPER; NICKEL; PHENYLALANINE; TRYPTOPHAN; TYROSINE; ZINC;

ARTICLE; CHEMICAL STRUCTURE; HYDRATION; METAL BINDING; PRIORITY JOURNAL; QUANTUM CHEMISTRY;

CATIONS; CHEMISTRY, ORGANIC; COPPER; GASES; MODELS, MOLECULAR; MOLECULAR CONFORMATION; NICKEL; PHENYLALANINE; QUANTUM THEORY; THERMODYNAMICS; TRYPTOPHAN; TYROSINE; WATER; ZINC;

EID: 84855660106     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-011-1000-0     Document Type: Article

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