Title :
Computer simulation of conformational behaviour of human and rat/mouse hemokinin-1 molecules
Author :
Agaeva, U.T. ; Agaeva, G.A. ; Godjaev, N.M.
Author_Institution :
Inst. for Phys. Problems, Baku State Univ., Baku, Azerbaijan
Abstract :
The conformational properties of biologically active human and mouse/rat hemokinin-1 peptide molecules have been investigated by computer modeling methods. It is showed that both molecule can exist in several stable conformational states. The energy and geometrical parameters for each of low-energy conformations of molecules are obtained. The conformationally rigid and labile segments of both molecules were revealed.
Keywords :
biology computing; digital simulation; zoology; biologically active human; computer modeling methods; computer simulation; conformational behaviour; energy parameter; geometrical parameter; low-energy conformations; mouse hemokinin-1 peptide molecules; rat hemokinin-1 peptide molecules; Biological information theory; Educational institutions; Electrostatics; Hydrogen; Mice; Peptides; Physiology; conformation; function; human hemokinin-I; mouse/rat hemokiran-1; peptide;
Conference_Titel :
Application of Information and Communication Technologies (AICT), 2014 IEEE 8th International Conference on
Conference_Location :
Astana
Print_ISBN :
978-1-4799-4120-9
DOI :
10.1109/ICAICT.2014.7035993
