Progress in Computer Simulation of Bulk, Confined, and Surface‐initiated Polymerizations

摘要: In this article we provide a brief summary of computational techniques applied to investigate polymerization reactions in general, with focus on systems under confinement and initiated from surfaces. We concentrate two major classes techniques, i.e., stochastic methods molecular modeling. describe the principles methodologies point out their strengths weaknesses. review variety studies literature conclude an outlook these computer simulation approaches as they are ‘‘grafting from’’ polymerizations.