Structural transitions in helical polymers

ORAL

Abstract

Helical structures, as well as more complex tertiary structures, made up of helixes are relevant in biological systems. We perform generalized-ensemble Monte Carlo simulations to examine homopolymer models which include a torsional potential energy associated with each bond. With the inclusion of a torsional potential, helical structures emerge and can contort to form a variety of tertiary structural phases. We explore the two-dimensional space, parametrized by temperature and torsional energy scale, to map helical structures and to locate structural transitions. We see transitions occur between helical and non-helical secondary structures and also between various tertiary structures.

Authors

  • Matthew Williams

    UGA

  • Michael Bachmann

    The Univ of Georgia, Center for Simulational Physics University of Georgia, UGA