Multi-selfoverlap-ensemble Monte Carlo method for lattice proteins and heteropolymers

Citation
M. Kikuchi et al., Multi-selfoverlap-ensemble Monte Carlo method for lattice proteins and heteropolymers, PROG T PH S, (138), 2000, pp. 404-405
Citations number
6
Categorie Soggetti
Physics
Journal title
PROGRESS OF THEORETICAL PHYSICS SUPPLEMENT
ISSN journal
03759687 → ACNP
Issue
138
Year of publication
2000
Pages
404 - 405
Database
ISI
SICI code
0375-9687(2000):138<404:MMCMFL>2.0.ZU;2-V
Abstract
A new Monte Carlo method for lattice heteropolymers is proposed. It is a tw o variable extention of the multicanonical ensemble method, which contains some portion of unphysical self-overlapping conformations. Correct canonica l ensemble of the self-avoiding chain is obtained by reweighting of the his togram after the simulation is done. The performance of the method is super ior to the standard multicanonical ensemble. Applications to long lattice p roteins are presented.