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We propose Characteristic-Neural Ordinary Differential Equations (C-NODEs), a framework for extending Neural Ordinary Differential Equations (NODEs) beyond ODEs. While NODEs model the evolution of a latent variables as the solution to an…

Machine Learning · Computer Science 2022-11-10 Xingzi Xu , Ali Hasan , Khalil Elkhalil , Jie Ding , Vahid Tarokh

Recently, graph neural networks (GNNs) have proved to be suitable in tasks on unstructured data. Particularly in tasks as community detection, node classification, and link prediction. However, most GNN models still operate with static…

Machine Learning · Computer Science 2019-06-07 Darwin Saire Pilco , Adín Ramírez Rivera

The existence or not of pathologies in the context of Lagrangian theory is studied with the aid of Machine Learning algorithms. Using an example in the framework of classical mechanics, we make a proof of concept, that the construction of…

Computational Physics · Physics 2021-09-15 Christos Valelis , Fotios K. Anagnostopoulos , Spyros Basilakos , Emmanuel N. Saridakis

Neural operators generalize neural networks to learn mappings between function spaces from data. They are commonly used to learn solution operators of parametric partial differential equations (PDEs) or propagators of time-dependent PDEs.…

Machine Learning · Computer Science 2025-02-03 Emilia Magnani , Marvin Pförtner , Tobias Weber , Philipp Hennig

In the last decade, the scientific community has devolved its attention to the deployment of data-driven approaches in scientific research to provide accurate and reliable analysis of a plethora of phenomena. Most notably, Physics-informed…

Machine Learning · Computer Science 2023-06-21 Mattia Silvestri , Federico Baldo , Eleonora Misino , Michele Lombardi

Recent works have shown that deep neural networks can be employed to solve partial differential equations, giving rise to the framework of physics informed neural networks. We introduce a generalization for these methods that manifests as a…

Numerical Analysis · Mathematics 2021-03-25 Remco van der Meer , Cornelis Oosterlee , Anastasia Borovykh

Neural ordinary differential equations (NODEs) is an invertible neural network architecture promising for its free-form Jacobian and the availability of a tractable Jacobian determinant estimator. Recently, the representation power of NODEs…

Machine Learning · Computer Science 2020-12-07 Takeshi Teshima , Koichi Tojo , Masahiro Ikeda , Isao Ishikawa , Kenta Oono

Partial Differential Equations (PDEs) are used to model a variety of dynamical systems in science and engineering. Recent advances in deep learning have enabled us to solve them in a higher dimension by addressing the curse of…

Physical systems are commonly represented as a combination of particles, the individual dynamics of which govern the system dynamics. However, traditional approaches require the knowledge of several abstract quantities such as the energy or…

Machine Learning · Computer Science 2022-09-07 Ravinder Bhattoo , Sayan Ranu , N. M. Anoop Krishnan

Neural Networks (NNs) have provided state-of-the-art results for many challenging machine learning tasks such as detection, regression and classification across the domains of computer vision, speech recognition and natural language…

Machine Learning · Statistics 2026-04-21 Ethan Goan , Clinton Fookes

We introduce a new family of deep neural network models. Instead of specifying a discrete sequence of hidden layers, we parameterize the derivative of the hidden state using a neural network. The output of the network is computed using a…

Machine Learning · Computer Science 2019-12-17 Ricky T. Q. Chen , Yulia Rubanova , Jesse Bettencourt , David Duvenaud

To better conform to data geometry, recent deep generative modelling techniques adapt Euclidean constructions to non-Euclidean spaces. In this paper, we study normalizing flows on manifolds. Previous work has developed flow models for…

Machine Learning · Statistics 2020-06-19 Aaron Lou , Derek Lim , Isay Katsman , Leo Huang , Qingxuan Jiang , Ser-Nam Lim , Christopher De Sa

A key appeal of the recently proposed Neural Ordinary Differential Equation (ODE) framework is that it seems to provide a continuous-time extension of discrete residual neural networks. As we show herein, though, trained Neural ODE models…

Machine Learning · Computer Science 2023-09-12 Katharina Ott , Prateek Katiyar , Philipp Hennig , Michael Tiemann

We introduce Lagrangian Flow Networks (LFlows) for modeling fluid densities and velocities continuously in space and time. By construction, the proposed LFlows satisfy the continuity equation, a PDE describing mass conservation in its…

Machine Learning · Computer Science 2023-12-15 F. Arend Torres , Marcello Massimo Negri , Marco Inversi , Jonathan Aellen , Volker Roth

Neural Ordinary Differential Equations model dynamical systems with ODEs learned by neural networks. However, ODEs are fundamentally inadequate to model systems with long-range dependencies or discontinuities, which are common in…

Machine Learning · Computer Science 2022-06-15 Samuel Holt , Zhaozhi Qian , Mihaela van der Schaar

We introduce a novel neural network structure called Strongly Constrained Theory-Guided Neural Network (SCTgNN), to investigate the behaviours of the localized solutions of the generalized nonlinear Schr\"{o}dinger (NLS) equation. This…

Pattern Formation and Solitons · Physics 2024-07-11 Thulasidharan K. , Sinthuja N. , Vishnu Priya N. , Senthilvelan M

Higher-order graph neural networks (HOGNNs) and the related architectures from Topological Deep Learning are an important class of GNN models that harness polyadic relations between vertices beyond plain edges. They have been used to…

Graph neural networks (GNNs) have achieved impressive performance when testing and training graph data come from identical distribution. However, existing GNNs lack out-of-distribution generalization abilities so that their performance…

Machine Learning · Computer Science 2021-12-15 Haoyang Li , Xin Wang , Ziwei Zhang , Wenwu Zhu

A fundamental question in deep learning concerns the role played by individual layers in a deep neural network (DNN) and the transferable properties of the data representations which they learn. To the extent that layers have clear roles,…

Machine Learning · Computer Science 2019-06-14 Oded Ben-David , Zohar Ringel

Complex nonlinear dynamics are ubiquitous in many fields. Moreover, we rarely have access to all of the relevant state variables governing the dynamics. Delay embedding allows us, in principle, to account for unobserved state variables.…

Machine Learning · Computer Science 2022-04-27 Uttam Bhat , Stephan B. Munch