Maximum likelihood estimation of potential energy in interacting particle systems from single-trajectory data
Xiaohui Chen

TL;DR
This paper demonstrates that maximum likelihood estimation can effectively recover the quadratic potential energy parameter in high-dimensional interacting particle systems from single-trajectory data, achieving optimal convergence rates.
Contribution
It shows that vanilla maximum likelihood estimation can accurately estimate interaction potential parameters in high-dimensional systems without regularization.
Findings
MLE achieves optimal convergence rates in mean-field and long-time limits.
Estimation avoids curse-of-dimensionality due to symmetry in particle interactions.
Method applicable to high-dimensional, single-trajectory data.
Abstract
This paper concerns the parameter estimation problem for the quadratic potential energy in interacting particle systems from continuous-time and single-trajectory data. Even though such dynamical systems are high-dimensional, we show that the vanilla maximum likelihood estimator (without regularization) is able to estimate the interaction potential parameter with optimal rate of convergence simultaneously in mean-field limit and in long-time dynamics. This to some extend avoids the curse-of-dimensionality for estimating large dynamical systems under symmetry of the particle interaction.
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Taxonomy
TopicsModel Reduction and Neural Networks · Protein Structure and Dynamics · Markov Chains and Monte Carlo Methods
