Move set, algorithm, and folding kinetics of Monte Carlo simulations for lattice polymers

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The effect of different move sets on the folding kinetics of the Monte Carlo simulations is analysed based on the conformation-network and the temperature-dependent folding kinetics. A new scheme of implementing Metropolis algorithm is given. The new method is shown to satisfy the detailed balance and converge efficiently towards thermal equilibrium. A new quantity, employed from the continuous time Monte Carlo method, is introduced to identify effectively the kinetic traps of foldings.
4 pages, 3 figures

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Soft Condensed Matter

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http://salesiana.dossiersoluciones.com/handle/123456789/105539

Consulte el texto completo en el siguiente enlace:

https://arxiv.org/abs/cond-mat/0512263
 http://arxiv.org/abs/cond-mat/0512263

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arXiv