Umbrella sampling: Difference between revisions
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Carl McBride (talk | contribs) (New page: {{Stub-general}} '''Umbrella sampling''' is a Monte Carlo technique for estimation of the Helmholtz energy function. ==Non-equilibrium processes== *[http://dx.doi.org/10.1063/1.278...) |
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Umbrella sampling is a Monte Carlo technique for estimation of the Helmholtz energy function.
Non-equilibrium processes
References
- Glenn M. Torrie and John P. Valleau "Monte Carlo free energy estimates using non-Boltzmann sampling: Application to the sub-critical Lennard-Jones fluid", Chemical Physics Letters 28 pp. 578-581 (1974)
- G. M. Torrie and J. P. Valleau "Nonphysical sampling distributions in Monte Carlo free-energy estimation: Umbrella sampling", Journal of Computational Physics 23 pp. 187-199 (1977)