Improving dynamical properties of metropolized discretizations of overdamped Langevin dynamics
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Abstract: The discretization of overdamped Langevin dynamics, through schemes such as the Euler-Maruyama method, can be corrected by some acceptance/rejection rule, based on a Metropolis-Hastings criterion for instance. In this case, the invariant measure sampled by the Markov chain is exactly the Boltzmann-Gibbs measure. However, rejections perturb the dynamical consistency of the resulting numerical method with the reference dynamics. We present in this work some modifications of the standard correction of discretizations of overdamped Langevin dynamics on compact spaces by a Metropolis-Hastings procedure, which allow us to either improve the strong order of the numerical method, or to decrease the bias in the estimation of transport coefficients characterizing the effective dynamical behavior of the dynamics. For the latter approach, we rely on modified numerical schemes together with a Barker rule for the acceptance/rejection criterion.
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Cites work
- scientific article; zbMATH DE number 1022658 (Why is no real title available?)
- scientific article; zbMATH DE number 953296 (Why is no real title available?)
- scientific article; zbMATH DE number 2114382 (Why is no real title available?)
- A patch that imparts unconditional stability to explicit integrators for Langevin-like equations
- Equation of state calculations by fast computing machines
- Ergodicity for SDEs and approximations: locally Lipschitz vector fields and degenerate noise.
- Error analysis of modified Langevin dynamics
- Error analysis of the transport properties of metropolized schemes
- Exponential convergence of Langevin distributions and their discrete approximations
- Fast Langevin based algorithm for MCMC in high dimensions
- Free energy computations. A mathematical perspective
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- High weak order methods for stochastic differential equations based on modified equations
- Metropolis integration schemes for self-adjoint diffusions
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- Partial differential equations and stochastic methods in molecular dynamics
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- The computation of averages from equilibrium and nonequilibrium Langevin molecular dynamics
- Yet Another Look at Harris’ Ergodic Theorem for Markov Chains
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