Efficient computation, sensitivity, and error analysis of committor probabilities for complex dynamical processes

DOI10.1137/100789191MaRDI QIDQ3098538zbMATH OpenOpenAlexFDO

Authors Jan-Hendrik Prinz, M. Held, Jeremy C. Smith, Frank Noé

Publication date 17 November 2011

Published in Multiscale Modeling & Simulation (Search for Journal in Brave)

Full work available at URL https://semanticscholar.org/paper/122d237199dae05a46f3743bb5e15a7c06636f93

zbMATH Keywords

uncertainty estimationdiffusion dynamicsMarkov state modelcommittor probability

Mathematics Subject Classification ID

Computational methods in Markov chains (60J22) Numerical analysis or methods applied to Markov chains (65C40) Continuous-time Markov processes on discrete state spaces (60J27)

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Cited in

(8)

• Point cloud discretization of Fokker-Planck operators for committor functions
• Estimation and validation of Markov models
• Efficient Computation of Extreme Excursion Probabilities for Dynamical Systems through Rice's Formula
• Reactive trajectories and the transition path process
• Optimal estimation of free energies and stationary densities from multiple biased simulations
• Coupling rare event algorithms with data-based learned committor functions using the analogue Markov chain
• Local and global perspectives on diffusion maps in the analysis of molecular systems
• A finite expression method for solving high-dimensional committor problems

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