NeurIPS 2021poster53 citations

Machine learning structure preserving brackets for forecasting irreversible processes

Kookjin Lee, Nathaniel Trask, Panos Stinis

Abstract

Forecasting of time-series data requires imposition of inductive biases to obtain predictive extrapolation, and recent works have imposed Hamiltonian/Lagrangian form to preserve structure for systems with \emph{reversible} dynamics. In this work we present a novel parameterization of dissipative brackets from metriplectic dynamical systems appropriate for learning \emph{irreversible} dynamics with unknown a priori model form. The process learns generalized Casimirs for energy and entropy guaranteed to be conserved and nondecreasing, respectively. Furthermore, for the case of added thermal noise, we guarantee exact preservation of a fluctuation-dissipation theorem, ensuring thermodynamic consistency. We provide benchmarks for dissipative systems demonstrating learned dynamics are more robust and generalize better than either "black-box" or penalty-based approaches.

structure preserving machine learningneural odesforecastingdissipative systems
BibTeX
@inproceedings{
lee2021machine,
title={Machine learning structure preserving brackets for forecasting irreversible processes},
author={Kookjin Lee and Nathaniel Trask and Panos Stinis},
booktitle={Advances in Neural Information Processing Systems},
editor={A. Beygelzimer and Y. Dauphin and P. Liang and J. Wortman Vaughan},
year={2021},
url={https://openreview.net/forum?id=ntAkYRaIfox}
}