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Conference publications

The discussion of bioactive nanocomplexes inhibition model

Vasil’eva L. Yu., Romanova E. Yu.

Russia, Moscow

"Математика. Компьютер. Образование". Cб. трудов XII международной конференции. Под общей редакцией Г.Ю. Ризниченко Ижевск: Научно-издательский центр "Регулярная и хаотическая динамика", 2005. Vol. 3, 344pp. Pp. 917-922.

It is discussed the mathematical model of the functional mechanisms of some metalloenzyme active centres. The models have been constructed on the basis of the crystalline field theory, molecular orbitals theory, the group theory, the symmetry theory, the ligand field theory. It is considered the molecular fragment — the active centre as the coordination connection. The algorithm of the model construction is based on the supposition that the functional mechanisms of the active centres are universal. The considered models are qualitative.



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