Monte Carlo Procedures for Generation of Nonintersecting Chains
- 1 October 1962
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 37 (7) , 1461-1465
- https://doi.org/10.1063/1.1733306
Abstract
A new method is described for high‐speed computer generation of non‐self‐intersecting random walks for use as models of coiling‐type polymer molecules. Previous methods for the unbiased generation of self‐avoiding random walks have proved to be statistically inadequate when certain intramolecular interactions are assumed to exist. This situation arises because energetically important configurations may have a very low probability of occurrence in a normal sample. With this problem in mind, a method of generating samples in a biased fashion has been developed. The procedure allows energetically important configurations to be generated in such a way that the actual amount of bias can be calculated and compensated for, and the samples so obtained can be incorporated with those obtained in a normal, unbiased way. Data are presented to show how the attrition attending the generation of samples depends on bias.Keywords
This publication has 12 references indexed in Scilit:
- Probability of Initial Ring Closure in the Restricted Random-Walk Model of a MacromoleculeThe Journal of Chemical Physics, 1961
- Some Counting Theorems in the Theory of the Ising Model and the Excluded Volume ProblemJournal of Mathematical Physics, 1961
- STATISTICAL THERMODYNAMICS OF COILING‐TYPE POLYMERS*Annals of the New York Academy of Sciences, 1961
- New Method for the Statistical Computation of Polymer DimensionsThe Journal of Chemical Physics, 1959
- Improved Statistical Method for Computing Mean Dimensions of Polymer MoleculesThe Journal of Chemical Physics, 1957
- Statistical Computation of Mean Dimensions of Polymer Molecules. IVThe Journal of Chemical Physics, 1957
- Statistical Computation of Mean Dimensions of Macromolecules. IIIThe Journal of Chemical Physics, 1955
- Statistical Computation of Mean Dimensions of Macromolecules. IIThe Journal of Chemical Physics, 1955
- Monte Carlo Calculation of the Average Extension of Molecular ChainsThe Journal of Chemical Physics, 1955
- Statistical Computation of Mean Dimensions of Macromolecules. IThe Journal of Chemical Physics, 1954