A Density Functional Theory Investigation into the Binding of the Antioxidants Ergothioneine and Ovothiol to Copper
- Author
- DE LUNA, Phil1 ; BUSHNELL, Eric A. C1 ; GAULD, James W1
[1] Department of Chemistry and Biochemistry, University of Windsor, Windsor, Ontario N9B 3P4, Canada - Source
The journal of physical chemistry. A. 2013, Vol 117, Num 19, pp 4057-4065, 9 p ; ref : 57 ref
- ISSN
- 1089-5639
- Scientific domain
- General chemistry, physical chemistry; Materials; Atomic molecular physics
- Publisher
- American Chemical Society, Washington, DC
- Publication country
- United States
- Document type
- Article
- Language
- English
- Keyword (fr)
- Cuivre Atome Cuivre Etude théorique Longueur liaison Méthode fonctionnelle densité 3115E Cu Métal transition
- Keyword (en)
- Copper Atoms Copper Theoretical study Bond lengths Density functional method Transition elements
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30A Electronic structure of atoms, molecules and their ions: theory / 001B30A15 Calculations and mathematical techniques in atomic and molecular physics (excluding electron correlation calculations) / 001B30A15E Density-functional theory
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 28203642
Sauf mention contraire ci-dessus, le contenu de cette notice bibliographique peut être utilisé dans le cadre d’une licence CC BY 4.0 Inist-CNRS / Unless otherwise stated above, the content of this bibliographic record may be used under a CC BY 4.0 licence by Inist-CNRS / A menos que se haya señalado antes, el contenido de este registro bibliográfico puede ser utilizado al amparo de una licencia CC BY 4.0 Inist-CNRS
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DOI
10.1021/jp402514w 
https://dx.doi.org/10.1021/jp402514w
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