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Main Authors: Lu, Yubin, Li, Xiaofan, Liu, Chun, Tang, Qi, Wang, Yiwei
Format: Preprint
Published: 2026
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Online Access:https://arxiv.org/abs/2604.20188
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author Lu, Yubin
Li, Xiaofan
Liu, Chun
Tang, Qi
Wang, Yiwei
author_facet Lu, Yubin
Li, Xiaofan
Liu, Chun
Tang, Qi
Wang, Yiwei
contents Learning the underlying potential energy of stochastic gradient systems from partial and noisy observations is a fundamental problem arising in physics, chemistry, and data-driven modeling. Classical approaches often rely on direct regression of governing equations or velocity fields, which can be sensitive to noise and external perturbations and may fail when observations are incomplete. In this work, we propose a structure-aware, energy-based learning framework for inferring unknown potential functions in generalized diffusion processes, grounded in the energetic variational approach. Starting from the energy-dissipation law associated with the Fokker-Planck equation, we construct loss functions based on the De Giorgi dissipation functional, which consistently couple the free energy and the dissipation mechanism of the system. This formulation avoids explicit enforcement of the governing partial differential equation and preserves the underlying variational structure of the dynamics. Through numerical experiments in one, two, and three dimensions, we demonstrate that the proposed energy-based loss exhibits enhanced robustness with respect to observation time, noise level, and the diversity and amount of available training data. These results highlight the effectiveness of energy-dissipation principles as a reliable foundation for learning stochastic diffusion dynamics from data.
format Preprint
id arxiv_https___arxiv_org_abs_2604_20188
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Structure-Aware Variational Learning of a Class of Generalized Diffusions
Lu, Yubin
Li, Xiaofan
Liu, Chun
Tang, Qi
Wang, Yiwei
Machine Learning
Dynamical Systems
Learning the underlying potential energy of stochastic gradient systems from partial and noisy observations is a fundamental problem arising in physics, chemistry, and data-driven modeling. Classical approaches often rely on direct regression of governing equations or velocity fields, which can be sensitive to noise and external perturbations and may fail when observations are incomplete. In this work, we propose a structure-aware, energy-based learning framework for inferring unknown potential functions in generalized diffusion processes, grounded in the energetic variational approach. Starting from the energy-dissipation law associated with the Fokker-Planck equation, we construct loss functions based on the De Giorgi dissipation functional, which consistently couple the free energy and the dissipation mechanism of the system. This formulation avoids explicit enforcement of the governing partial differential equation and preserves the underlying variational structure of the dynamics. Through numerical experiments in one, two, and three dimensions, we demonstrate that the proposed energy-based loss exhibits enhanced robustness with respect to observation time, noise level, and the diversity and amount of available training data. These results highlight the effectiveness of energy-dissipation principles as a reliable foundation for learning stochastic diffusion dynamics from data.
title Structure-Aware Variational Learning of a Class of Generalized Diffusions
topic Machine Learning
Dynamical Systems
url https://arxiv.org/abs/2604.20188