Efficient free energy profile reconstruction using adaptive stochastic perturbation protocols

Details Efficient free energy profile reconstruction using adaptive stochastic perturbation protocols Efficient free energy profile reconstruction using adaptive stochastic perturbation protocols

2007-12-31

arxiv.org/abs/0801.0178v1

Physics

Condensed Matter

Statistical Mechanics

LaTeX (revtex4), 4 pages, 4 Postscript figures

Scientific paper

Application of Jarzynski nonequilibrium work relation to free energy calculation is limited by the very slow convergence of the estimate when dissipation is high. We present a novel perturbation protocol able to improve the convergence of Jarzynski estimator when it is applied in the reconstruction of the potential of mean force. The improvement is based on the application of the adaptive external work variation in addition to the one caused by thermal fluctuations.

Affiliated with

Also associated with

No associations

Rating

Efficient free energy profile reconstruction using adaptive stochastic perturbation protocols does not yet have a rating. At this time, there are no reviews or comments for this scientific paper.

If you have personal experience with Efficient free energy profile reconstruction using adaptive stochastic perturbation protocols, we encourage you to share that experience with our LandOfFree.com community. Your opinion is very important and Efficient free energy profile reconstruction using adaptive stochastic perturbation protocols will most certainly appreciate the feedback.

Rate now

Comments { 0 }

Profile ID: LFWR-SCP-O-234991