Estimating Irreversibility in Nonequilibrium Systems using Contrastive Learning

ORAL

Abstract

The dynamics of nonequilibrium steady states and out-of-equilibrium processes are intrinsically linked to the arrow of time. This encompasses many complex systems such as the paradigmatic model of coupled oscillators exchanging heat with several baths, and biological processes such as dissipation in the actomyosin cortex powered by ATP hydrolysis. While the arrow of time is well understood in terms of stochastic entropy and transition rates, the practical estimation of the entropy production rate has proven to be challenging for real high-dimensional and nonlinear data. In this work, we propose a new and tractable statistical estimator for measuring reversibility. In contrast with previous methods which estimate the absolute likelihoods of future observations given present conditions, we obtain an estimate of the irreversibility in terms of the relative likelihoods between forward and backward state transitions through a suitable optimization procedure. This is substantially easier to compute and corresponds to the process of learning a classifier which distinguishes between forward (likely) and reverse (unlikely) state transitions. Numerically, we show that this estimator recovers the expected entropy production rates for simple non-equilibrium processes. We also report progress on scaling our method to high-dimensional experimental data in the form of high-resolution videos of biological systems, without requiring coarse-graining or discretization.

*This work was partially supported by a joint research agreement between Princeton University and NTT Research Inc. The author(s) are also pleased to acknowledge that the work reported on in this paper was substantially performed using the Princeton Research Computing resources at Princeton University which is consortium of groups led by the Princeton Institute for Computational Science and Engineering (PICSciE) and Office of Information Technology's Research Computing.

Presenters

  • Ravin Raj

    • Princeton University

Authors

  • Ravin Raj

    • Princeton University
  • Catherine Ji

    • Princeton University
  • Gautam Reddy

    • Princeton University
  • Benjamin Eysenbach

    • Princeton University