Informed Machine Learning with a Stochastic-Gradient-based Algorithm for Training with Hard Constraints

27 Sept 2024 (modified: 05 Feb 2025)Submitted to ICLR 2025EveryoneRevisionsBibTeXCC BY 4.0
Keywords: nonlinear optimization, stochastic gradient methods, constrained optimization, physics-informed learning
Abstract: A methodology for informed machine learning is presented and its effectiveness is shown through numerical experiments with physics-informed learning problems. The methodology has three main distinguishing features. Firstly, prior information is introduced in the training problem through hard constraints rather than through the typical modern practice of using soft constraints (i.e., regularization terms). Secondly, the methodology does not employ penalty-based (e.g., augmented Lagrangian) methods since the use of such methods results in an overall methodology that is similar to a soft-constrained approach. Rather, the methodology is based on a recently proposed stochastic-gradient-based algorithm that maintains computationally efficiency while handling constraints with a Newton-based technique. Thirdly, a new projection-based variant of the well-known Adam optimization methodology is proposed for settings with hard constraints. Numerical experiments on a set of physics-informed learning problems show that, when compared with a soft-constraint approach, the proposed methodology can be easier to tune, lead to accurate predictions more quickly, and lead to better final prediction accuracy.
Supplementary Material: zip
Primary Area: optimization
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Submission Number: 8860
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