Confinement causes opposite effects on the folding transition of a single polymer chain depending on its stiffness

Phys Rev E Stat Nonlin Soft Matter Phys. 2011 Aug;84(2 Pt 1):021924. doi: 10.1103/PhysRevE.84.021924. Epub 2011 Aug 22.

Abstract

We investigated the folding transition between an elongated coil state and a compact state on a single polymer chain confined in a small space with different stiffness with the aid of Monte Carlo simulation. In a flexible polymer, the folding transition is retarded in a confined space. In contrast, the transition is promoted for a semiflexible chain, in which the discontinuity of the volume change occupied by a single chain is diminished by confinement. This unique confinement effect is interpreted in terms of conformational entropy and self-avoiding repulsive interaction.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Models, Molecular*
  • Molecular Conformation*
  • Monte Carlo Method
  • Polymers / chemistry*

Substances

  • Polymers