DocumentCode
2959674
Title
Effect of the transition metals on the carnosine coordination complexes structure
Author
Demukhamedova, S.D. ; Alieva, I.N. ; Gojayev, N.M.
Author_Institution
Inst. for Phys. Problems, Baku State Univ., Baku, Azerbaijan
fYear
2009
fDate
14-16 Oct. 2009
Firstpage
1
Lastpage
4
Abstract
The spatial and electronic structures of the carnosine monomer coordination complexes with zinc and copper ions were investigated by the semi-empirical of MM+ molecular mechanics and PM3 quantum chemistry methods. The effect of the transition atoms on the geometrical and energy parameters of the monomer complexes with two forms of imidazole ring was studied.
Keywords
PM3 calculations; copper; molecular configurations; molecular dynamics method; molecular electronic states; organic compounds; zinc; Cu; MM+ molecular mechanics; PM3 quantum chemistry methods; Zn; carnosine coordination complexes structure; copper ions; electronic structures; imidazole ring; semi-empirical methods; spatial structures; transition atoms; transition metal effect; zinc ions; Chemistry; Copper; Hypercubes; Quantum mechanics; Zinc;
fLanguage
English
Publisher
ieee
Conference_Titel
Application of Information and Communication Technologies, 2009. AICT 2009. International Conference on
Conference_Location
Baku
Print_ISBN
978-1-4244-4739-8
Electronic_ISBN
978-1-4244-4740-4
Type
conf
DOI
10.1109/ICAICT.2009.5372539
Filename
5372539
Link To Document