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A quantum-chemical study of the binding ability of βXaaHisGlyHis towards copper(II) ion

The present study analyzed binding of Cu(2+) to tetrapeptides in water solution at several levels of theoretical approximation. The methods used to study the energetic and structural properties of the complexes in question include semiempirical hamiltonians, density functional theory as well as ab i...

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Detalles Bibliográficos
Autores principales: Czyżnikowska, Żaneta, Brasuń, Justyna
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer-Verlag 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3313029/
https://www.ncbi.nlm.nih.gov/pubmed/21761180
http://dx.doi.org/10.1007/s00894-011-1162-9

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