The spatial structure and electron properties of the Gly-Glu-His-Phe-Pro-Gly-Pro molecule

The spatial and electron structure of the heptapeptide molecule Gly-Glu-His-Phe-Pro-Gly-Pro were investigated using semiempirical methods. By theoretical conformational analysis method has been investigated the low-energy conformations, geometric and energetic parameters of this molecule. By quantum-chemical method of CNDO/2 has been determined sharing electronic density and value of dipole moments of this molecule.