On the relation between projections of the reweighted path ensemble

DOI10.1007/S10955-011-0324-6MaRDI QIDQ658458zbMATH OpenOpenAlexFDO

Authors Peter G. Bolhuis, Wolfgang Lechner

Publication date 12 January 2012

Published in Journal of Statistical Physics (Search for Journal in Brave)

Copyright license Creative Commons Attribution-NonCommercial 4.0 International

Full work available at URL https://doi.org/10.1007/s10955-011-0324-6

zbMATH Keywords

rate constantsrare event simulationstransition path sampling

Mathematics Subject Classification ID

Stochastic methods (Fokker-Planck, Langevin, etc.) applied to problems in time-dependent statistical mechanics (82C31) Classical dynamic and nonequilibrium statistical mechanics (general) (82C05)

Recommendations

• Towards a theory of transition paths
• Elaborating transition interface sampling methods
• The inefficiency of re-weighted sampling and the curse of system size in high-order path integration
• Transition Path Theory
• A review of Girsanov reweighting and of square root approximation for building molecular Markov state models

Cites work

• Elaborating transition interface sampling methods
• Minimum action method for the study of rare events
• Towards a theory of transition paths

Cited in

(3)

• The inefficiency of re-weighted sampling and the curse of system size in high-order path integration
• A review of Girsanov reweighting and of square root approximation for building molecular Markov state models
• Activation Energies from Transition Path Sampling Simulations

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