Сравнительное изучение динамики конформационных степеней свободы в серии природных дипептидов

The authors present a comparative study of molecular dynamicsof natural dipeptides using molecular dynamics protocols that do not lead to destruction of the equipartition of energy law on degrees of freedom. They discuss the Poincare sections, auto and cross-correlation functions for complex exponents of interfacial angles. A classificationof dynamic properties of conformational degrees of freedom according to the amino acid residues has been suggested.