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Solving for detailed chemical kinetics remains one of the major bottlenecks for computational fluid dynamics simulations of reacting flows using a finite-rate-chemistry approach. This has motivated the use of fully connected artificial…

计算工程、金融与科学 · 计算机科学 2021-10-11 Opeoluwa Owoyele , Pinaki Pal

The recently-introduced class of ordinary differential equation networks (ODE-Nets) establishes a fruitful connection between deep learning and dynamical systems. In this work, we reconsider formulations of the weights as…

机器学习 · 计算机科学 2021-11-09 Alejandro Queiruga , N. Benjamin Erichson , Liam Hodgkinson , Michael W. Mahoney

Despite the promise of scientific machine learning (SciML) in combining data-driven techniques with mechanistic modeling, existing approaches for incorporating hard constraints in neural differential equations (NDEs) face significant…

机器学习 · 计算机科学 2025-05-28 Avik Pal , Alan Edelman , Christopher Rackauckas

We present Neural Autoregressive Distribution Estimation (NADE) models, which are neural network architectures applied to the problem of unsupervised distribution and density estimation. They leverage the probability product rule and a…

机器学习 · 计算机科学 2016-05-30 Benigno Uria , Marc-Alexandre Côté , Karol Gregor , Iain Murray , Hugo Larochelle

Neural operator learning accelerates PDE solution by approximating operators as mappings between continuous function spaces. Yet in many engineering settings, varying geometry induces discrete structural changes, including topological…

机器学习 · 计算机科学 2026-03-04 Jinshuai Bai , Haolin Li , Zahra Sharif Khodaei , M. H. Aliabadi , YuanTong Gu , Xi-Qiao Feng

Continuous-depth neural networks, such as the Neural Ordinary Differential Equations (ODEs), have aroused a great deal of interest from the communities of machine learning and data science in recent years, which bridge the connection…

机器学习 · 计算机科学 2022-01-05 Qunxi Zhu , Yifei Shen , Dongsheng Li , Wei Lin

Despite their elegant formulation and lightweight memory cost, neural ordinary differential equations (NODEs) suffer from known representational limitations. In particular, the single flow learned by NODEs cannot express all homeomorphisms…

机器学习 · 计算机科学 2021-04-16 Mathieu Chalvidal , Matthew Ricci , Rufin VanRullen , Thomas Serre

This paper presents the Standalone Neural ODE (sNODE), a continuous-depth neural ODE model capable of describing a full deep neural network. This uses a novel nonlinear conjugate gradient (NCG) descent optimization scheme for training,…

机器学习 · 计算机科学 2022-06-09 Rym Jaroudi , Lukáš Malý , Gabriel Eilertsen , B. Tomas Johansson , Jonas Unger , George Baravdish

Almheiri, Dong, and Harlow [arXiv:1411.7041] proposed a highly illuminating connection between the AdS/CFT holographic correspondence and operator algebra quantum error correction (OAQEC). Here we explore this connection further. We derive…

量子物理 · 物理学 2017-05-23 Fernando Pastawski , John Preskill

We consider parameter estimation of ordinary differential equation (ODE) models from noisy observations. For this problem, one conventional approach is to fit numerical solutions (e.g., Euler, Runge--Kutta) of ODEs to data. However, such a…

统计方法学 · 统计学 2021-09-01 Takeru Matsuda , Yuto Miyatake

This paper introduces Volterra Neural Ordinary Differential Equations (VNODE), a piecewise continuous Volterra Neural Network that integrates nonlinear Volterra filtering with continuous time neural ordinary differential equations for image…

计算机视觉与模式识别 · 计算机科学 2025-09-30 Siddharth Roheda , Aniruddha Bala , Rohit Chowdhury , Rohan Jaiswal

We present Ordinary Differential Equation Variational Auto-Encoder (ODE$^2$VAE), a latent second order ODE model for high-dimensional sequential data. Leveraging the advances in deep generative models, ODE$^2$VAE can simultaneously learn…

机器学习 · 统计学 2019-10-25 Çağatay Yıldız , Markus Heinonen , Harri Lähdesmäki

This paper studies the expressive and computational power of discrete Ordinary Differential Equations (ODEs), a.k.a. (Ordinary) Difference Equations. It presents a new framework using these equations as a central tool for computation and…

计算机科学中的逻辑 · 计算机科学 2022-09-27 Olivier Bournez , Arnaud Durand

Neural ordinary differential equations (neural ODEs) are a popular family of continuous-depth deep learning models. In this work, we consider a large family of parameterized ODEs with continuous-in-time parameters, which include…

机器学习 · 统计学 2023-10-13 Pierre Marion

Neural ordinary differential equations (NODE) have been proposed as a continuous depth generalization to popular deep learning models such as Residual networks (ResNets). They provide parameter efficiency and automate the model selection…

机器学习 · 计算机科学 2021-12-24 Srinivas Anumasa , P. K. Srijith

Neural differential equations offer a powerful framework for modeling continuous-time dynamics, but forecasting stiff biophysical systems remains unreliable. Standard Neural ODEs and physics informed variants often require orders of…

The time evolution of dynamical systems is frequently described by ordinary differential equations (ODEs), which must be solved for given initial conditions. Most standard approaches numerically integrate ODEs producing a single solution…

机器学习 · 计算机科学 2020-06-26 Cedric Flamant , Pavlos Protopapas , David Sondak

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…

机器学习 · 计算机科学 2022-06-15 Samuel Holt , Zhaozhi Qian , Mihaela van der Schaar

Density functional theory (DFT) is the most widely used method for calculating molecular properties; however, its accuracy is often insufficient for quantitative predictions. Coupled-cluster (CC) theory is the most successful method for…

This paper proposes the use of spectral element methods \citep{canuto_spectral_1988} for fast and accurate training of Neural Ordinary Differential Equations (ODE-Nets; \citealp{Chen2018NeuralOD}) for system identification. This is achieved…

神经与进化计算 · 计算机科学 2020-01-20 Alessio Quaglino , Marco Gallieri , Jonathan Masci , Jan Koutník