A simulation algorithm is proposed in which the potential energy function used in a Monte Carlo simulation is replaced with one that is less expensive to evaluate, coupled with a correction step based on the difference between the two potentials. This can result in a substantial reduction in computational cost. A formal derivation of the appropriate sampling criteria is given, as well as estimates of the possible improvements in code performance. The method is demonstrated on the Lennard-Jones fluid at several state points, where speedups of as much as fourfold are achieved with negligible loss in precision.
No takes yet. Share an insight, caveat, or question.
Lev D. Gelb (2003) studied this question.
Synapse has enriched 5 closely related papers on similar clinical questions. Consider them for comparative context: