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We propose a machine learning framework to accelerate numerical computations of time-dependent ODEs and PDEs. Our method is based on recasting (generalizations of) existing numerical methods as artificial neural networks, with a set of…

Numerical Analysis · Mathematics 2019-03-08 Siddhartha Mishra

Orbital-free density functional theory (OF-DFT) holds the promise to compute ground state molecular properties at minimal cost. However, it has been held back by our inability to compute the kinetic energy as a functional of the electron…

Chemical Physics · Physics 2023-10-25 Roman Remme , Tobias Kaczun , Maximilian Scheurer , Andreas Dreuw , Fred A. Hamprecht

Neural ordinary differential equations (NODE) have garnered significant attention for their design of continuous-depth neural networks and the ability to learn data/feature dynamics. However, for high-dimensional systems, estimating…

Machine Learning · Computer Science 2025-10-07 Muhao Guo , Haoran Li , Yang Weng

Providing fast and accurate solutions to partial differential equations is a problem of continuous interest to the fields of applied mathematics and physics. With the recent advances in machine learning, the adoption learning techniques in…

Computational Physics · Physics 2019-04-16 S. Mohammad H. Hashemi , Demetri Psaltis

Neural operators have emerged as promising surrogate models for solving partial differential equations (PDEs), but struggle to generalise beyond training distributions and are often constrained to a fixed temporal discretisation. This work…

Ordinary Differential Equations (ODE) based models have become popular as foundation models for solving many time series problems. Combining neural ODEs with traditional RNN models has provided the best representation for irregular time…

Machine Learning · Computer Science 2024-08-06 Futoon M. Abushaqra , Hao Xue , Yongli Ren , Flora D. Salim

We present a methodology for integrating functional data into deep densely connected feed-forward neural networks. The model is defined for scalar responses with multiple functional and scalar covariates. A by-product of the method is a set…

Machine Learning · Statistics 2022-12-21 Barinder Thind , Kevin Multani , Jiguo Cao

We present a novel approach that redefines the traditional interpretation of explicit and implicit discretization methods for solving a general class of advection-diffusion equations (ADEs) featuring nonlinear advection, diffusion…

Analysis of PDEs · Mathematics 2025-06-10 Amin Jafarimoghaddam , Manuel Soler , Irene Ortiz

Neural Ordinary Differential Equation (Neural ODE) has been proposed as a continuous approximation to the ResNet architecture. Some commonly used regularization mechanisms in discrete neural networks (e.g. dropout, Gaussian noise) are…

Machine Learning · Computer Science 2019-06-07 Xuanqing Liu , Tesi Xiao , Si Si , Qin Cao , Sanjiv Kumar , Cho-Jui Hsieh

Deep belief networks are used extensively for unsupervised stochastic learning on large datasets. Compared to other deep learning approaches their layer-by-layer learning makes them highly scalable. Unfortunately, the principles by which…

Disordered Systems and Neural Networks · Physics 2019-07-15 Swapnil Nitin Shah

As power systems transition toward renewable-rich and inverter-dominated operations, accurate time-domain dynamic analysis becomes increasingly critical. Such analysis supports key operational tasks, including transient stability…

Artificial Intelligence · Computer Science 2026-04-17 Haoran Li , Lihao Mai , Chenhan Xiao , Erik Blasch , Yang Weng

It is commonly believed that the hidden layers of deep neural networks (DNNs) attempt to extract informative features for learning tasks. In this paper, we formalize this intuition by showing that the features extracted by DNN coincide with…

Information Theory · Computer Science 2019-05-17 Shao-Lun Huang , Xiangxiang Xu , Lizhong Zheng , Gregory W. Wornell

Large pre-trained models, or foundation models, have shown impressive performance when adapted to a variety of downstream tasks, often out-performing specialized models. Hypernetworks, neural networks that generate some or all of the…

Machine Learning · Computer Science 2025-03-04 Jeffrey Gu , Serena Yeung-Levy

Differential equations are widely used to describe complex dynamical systems with evolving parameters in nature and engineering. Effectively learning a family of maps from the parameter function to the system dynamics is of great…

Machine Learning · Computer Science 2025-03-12 Xin Li , Chengli Zhao , Xue Zhang , Xiaojun Duan

In this paper, we introduce an efficient backpropagation scheme for non-constrained implicit functions. These functions are parametrized by a set of learnable weights and may optionally depend on some input; making them perfectly suitable…

Machine Learning · Computer Science 2020-11-17 Andreas Look , Simona Doneva , Melih Kandemir , Rainer Gemulla , Jan Peters

We present a hybrid transformer architecture that replaces discrete middle layers with a continuous-depth Neural Ordinary Differential Equation (ODE) block, enabling inference-time control over generation attributes via a learned steering…

Machine Learning · Computer Science 2026-01-16 Peter Jemley

Quantization of deep neural networks is a promising approach that reduces the inference cost, making it feasible to run deep networks on resource-restricted devices. Inspired by existing methods, we propose a new framework to learn the…

Machine Learning · Computer Science 2022-02-28 Amir Ardakani , Arash Ardakani , Brett Meyer , James J. Clark , Warren J. Gross

A novel approach for supervised classification is presented which sits at the intersection of machine learning and dynamical systems theory. At variance with other methodologies that employ ordinary differential equations for classification…

Disordered Systems and Neural Networks · Physics 2024-05-21 Raffaele Marino , Lorenzo Giambagli , Lorenzo Chicchi , Lorenzo Buffoni , Duccio Fanelli

Dynamic power system models are instrumental in real-time stability, monitoring, and control. Such models are traditionally posed as systems of nonlinear differential algebraic equations (DAEs): the dynamical part models generator…

Systems and Control · Electrical Eng. & Systems 2024-02-02 Mohamad H. Kazma , Ahmad F. Taha

Learning dynamics governed by differential equations is crucial for predicting and controlling the systems in science and engineering. Neural Ordinary Differential Equation (NODE), a deep learning model integrated with differential…

Machine Learning · Computer Science 2021-11-09 Shiqi Gong , Qi Meng , Yue Wang , Lijun Wu , Wei Chen , Zhi-Ming Ma , Tie-Yan Liu