Adaptive Stepsize Algorithms for Langevin Dynamics

We discuss the design of an invariant measure-preserving transformation for the numerical treatment of Langevin dynamics based on a rescaling of time, with the goal of sampling from an invariant measure. Given an appropriate monitor function which characterizes the numerical difficulty of the problem as a function of the state of the system, this method allows stepsizes to be reduced only when necessary, facilitating efficient recovery of long-time behavior. We study both overdamped and underdamped Langevin dynamics. We investigate how an appropriate correction term that ensures preservation of the invariant measure should be incorporated into a numerical splitting scheme. Finally, we demonstrate the use of the technique on several model systems, including a Bayesian sampling problem with a steep prior.

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Publication Details

Journal
SIAM Journal on Scientific Computing
Published
2024-11-13
DOI
https://doi.org/10.1137/24m1658590
Primary Topic
Markov Chains and Monte Carlo Methods
Type
article
Field-Weighted Citation Impact
0.00

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article

Adaptive Stepsize Algorithms for Langevin Dynamics

Benedict Leimkuhler, Jonas Latz, Desmond J. Higham, Agnés Leroy
SIAM Journal on Scientific Computing
Markov Chains and Monte Carlo Methods
article

Adaptive Stepsize Algorithms for Langevin Dynamics

Benedict Leimkuhler, Jonas Latz, Desmond J. Higham, Agnés Leroy
article en

Abstract

We discuss the design of an invariant measure-preserving transformation for the numerical treatment of Langevin dynamics based on a rescaling of time, with the goal of sampling from an invariant measure. Given an appropriate monitor function which characterizes the numerical difficulty of the problem as a function of the state of the system, this method allows stepsizes to be reduced only when necessary, facilitating efficient recovery of long-time behavior. We study both overdamped and underdamped Langevin dynamics. We investigate how an appropriate correction term that ensures preservation of the invariant measure should be incorporated into a numerical splitting scheme. Finally, we demonstrate the use of the technique on several model systems, including a Bayesian sampling problem with a steep prior.

SIAM Journal on Scientific ComputingVol. 46(6)
University of Manchester (GB), University of Edinburgh (GB)
Isaac Newton Institute for Mathematical Sciences, Fonds National de la Recherche Luxembourg, Engineering and Physical Sciences Research Council, Division of Mathematical Sciences
Openalex Percentile: Top 79%
Markov Chains and Monte Carlo Methods
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