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Efficient Training of Physics-enhanced Neural ODEs via Direct Collocation and Nonlinear Programming

arXiv 2505.03552 ↗First posted 6 May 2025cs.LG math.DS math.OCcited by 0

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Abstract (arXiv)

We propose a novel approach for training Physics-enhanced Neural ODEs (PeN-ODEs) by expressing the training process as a dynamic optimization problem. The full model, including neural components, is discretized using a high-order implicit Runge-Kutta method with flipped Legendre-Gauss-Radau points, resulting in a large-scale nonlinear program (NLP) efficiently solved by state-of-the-art NLP solvers such as Ipopt. This formulation enables simultaneous optimization of network parameters and state trajectories, addressing key limitations of ODE solver-based training in terms of stability, runtime, and accuracy. Extending on a recent direct collocation-based method for Neural ODEs, we generalize to PeN-ODEs, incorporate physical constraints, and present a custom, parallelized, open-source implementation. Benchmarks on a Quarter Vehicle Model and a Van-der-Pol oscillator demonstrate superior accuracy, speed, generalization with smaller networks compared to other training techniques. We also outline a planned integration into OpenModelica to enable accessible training of Neural DAEs.

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References · 7

  1. 2018Neural Ordinary Differential Equationscited by 3,733
  2. 2020Universal Differential Equations for Scientific Machine Learningcited by 345
  3. 2022Maximizing information from chemical engineering data sets: Applications to machine learningcited by 17
  4. 2021Accelerating Neural ODEs Using Model Order Reductioncited by 9
  5. 2025A Simultaneous Approach for Training Neural Differential-Algebraic Systems of Equationscited by 4
  6. 2022NeuralFMU: Presenting a workflow for integrating hybrid NeuralODEs into real world applicationscited by 3
  7. 2025Training Neural ODEs Using Fully Discretized Simultaneous Optimizationcited by 3

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