In the present workwas carried outmodeling of self-assembly of conductive polymer materials for hybridsensor systems for example polyacrylonitrile with silver metallic inclusions. Implementation of modeling was performed by the Wang-Landau and entropic Monte Carlo simulation based on a model with a fixed valence angle. For modeling polymerization process using an algorithm based on the principles of irreversible aggregation of Eden.Methods of quantum chemistry has been investigated and the possibility of obtaining the silver property PAN, as there doxpolymer.

Keywords: Hybrid sensor systems polyconjugated functional conductive polymers, metal-organic polymer composites, the energy of the Hartree-Focksemi conductor gas sensitive materials, mathematical modeling, Monte Carlo, quantum-chemical calculations