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Dynamic pruned-enriched Rosenbluth method

Authors :
combe, N.
Vlugt, T.J.H.
ten wolde, P.R.
Frenkel, D.
Colloïden en grenslagen
Grensvlakken
Universiteit Utrecht
Dep Scheikunde
Colloïden en grenslagen
Grensvlakken
Universiteit Utrecht
Dep Scheikunde
Molecular Simulations (HIMS, FNWI)
Source :
Molecular Physics, 101(11), 1675-1682. Taylor and Francis Ltd., Molecular physics, 101(11), 1675. Taylor & Francis group, Molecular Physics, 101, 1675. Taylor and Francis Ltd.
Publication Year :
2003

Abstract

Recently, Grassberger [1997, Phys. Rev. E, 56, 3682] has presented a new algorithm ('PERM') for simulating flexible polymer chains. This algorithm has been shown to have a good efficiency and has been used in a wide class of systems. A drawback of this algorithm is that it is static: it is therefore not suited for Markov-chain Monte Carlo simulations. Here, we present a dynamic generalization of the PERM algorithm. For a specific example, we compare the efficiency of DPERM to that of other Monte Carlo algorithms. In the case studied, we find that DPERM is only marginally more efficient. However, this result may depend on the details of the implementation.

Details

Language :
English
ISSN :
00268976
Database :
OpenAIRE
Journal :
Molecular Physics, 101(11), 1675-1682. Taylor and Francis Ltd., Molecular physics, 101(11), 1675. Taylor & Francis group, Molecular Physics, 101, 1675. Taylor and Francis Ltd.
Accession number :
edsair.doi.dedup.....ac219739ffb98d92f04a71cecc9cdace