Literature DB >> 17144734

A Monte Carlo simulation study of branched polymers.

Arun Yethiraj1.   

Abstract

Monte Carlo simulations are presented for the static properties of highly branched polymer molecules. The molecules consist of a semiflexible backbone of hard-sphere monomers with semiflexible side chains, also composed of hard-sphere monomers, attached to either every backbone bead or every other backbone bead. The conformational properties and structure factor of this model are investigated as a function of the stiffness of the backbone and side chains. The average conformations of the side chains are similar to self-avoiding random walks. The simulations show that there is a stiffening of the backbone as degree of crowding is increased, for example, if the branch spacing is decreased or side chain length is increased. The persistence length of the backbone is relatively insensitive to the stiffness of the side chains over the range investigated. The simulations reproduce most of the qualitative features of the structure factor observed in experiment, although the magnitude of the stiffening of the backbone is smaller than in experiment.

Entities:  

Year:  2006        PMID: 17144734     DOI: 10.1063/1.2374884

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  2 in total

1.  Analysis of the cluster formation in two-component cylindrical bottle-brush polymers under poor solvent conditions: a simulation study.

Authors:  P E Theodorakis; W Paul; K Binder
Journal:  Eur Phys J E Soft Matter       Date:  2011-05-25       Impact factor: 1.890

2.  Entropy-based mechanism of ribosome-nucleoid segregation in E. coli cells.

Authors:  Jagannath Mondal; Benjamin P Bratton; Yijie Li; Arun Yethiraj; James C Weisshaar
Journal:  Biophys J       Date:  2011-06-08       Impact factor: 4.033

  2 in total

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