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This paper studies a novel problem of out-of-distribution graph models merging, which aims to construct a generalized model from multiple graph models pre-trained on different domains with distribution discrepancy. This problem is…

Machine Learning · Computer Science 2026-03-18 Yidi Wang , Ziyue Qiao , Jiawei Gu , Xubin Zheng , Pengyang Wang , Xiaobing Pei , Xiao Luo

Graph Neural Networks (GNNs) have achieved significant success in machine learning, with wide applications in social networks, bioinformatics, knowledge graphs, and other fields. Most research assumes ideal closed-set environments. However,…

Machine Learning · Computer Science 2025-03-04 Yicong Dong , Rundong He , Guangyao Chen , Wentao Zhang , Zhongyi Han , Jieming Shi , Yilong Yin

Inferring the underlying graph topology that characterizes structured data is pivotal to many graph-based models when pre-defined graphs are not available. This paper focuses on learning graphs in the case of sequential data in dynamic…

Machine Learning · Computer Science 2022-02-25 Xiang Zhang

Effective interaction modeling and behavior prediction of dynamic agents play a significant role in interactive motion planning for autonomous robots. Although existing methods have improved prediction accuracy, few research efforts have…

Robotics · Computer Science 2024-01-09 Victoria M. Dax , Jiachen Li , Enna Sachdeva , Nakul Agarwal , Mykel J. Kochenderfer

Since the advent of the ``Neural Ordinary Differential Equation (Neural ODE)'' paper, learning ODEs with deep learning has been applied to system identification, time-series forecasting, and related areas. Exploiting the diffeomorphic…

Machine Learning · Statistics 2025-08-27 Yuji Okamoto , Tomoya Takeuchi , Yusuke Sakemi

Time-continuous dynamical systems defined on graphs are often used to model complex systems with many interacting components in a non-spatial context. In the reverse sense attaching meaningful dynamics to given 'interaction diagrams' is a…

Molecular Networks · Quantitative Biology 2010-07-02 Markus Kirkilionis , Luca Sbano

Deep neural networks achieve stellar generalisation on a variety of problems, despite often being large enough to easily fit all their training data. Here we study the generalisation dynamics of two-layer neural networks in a…

Machine Learning · Statistics 2019-06-21 Sebastian Goldt , Madhu S. Advani , Andrew M. Saxe , Florent Krzakala , Lenka Zdeborová

Detecting out-of-distribution (OOD) graphs is crucial for ensuring the safety and reliability of Graph Neural Networks. In unsupervised graph-level OOD detection, models are typically trained using only in-distribution (ID) data, resulting…

Machine Learning · Computer Science 2026-03-03 Li Sun , Lanxu Yang , Jiayu Tian , Bowen Fang , Xiaoyan Yu , Junda Ye , Peng Tang , Hao Peng , Philip S. Yu

Identifying dynamical systems from experimental data is a notably difficult task. Prior knowledge generally helps, but the extent of this knowledge varies with the application, and customized models are often needed. Neural ordinary…

Systems and Control · Electrical Eng. & Systems 2023-01-13 Mona Buisson-Fenet , Valery Morgenthaler , Sebastian Trimpe , Florent Di Meglio

Aerosol effects on climate, weather, and air quality depend on characteristics of individual particles, which are tremendously diverse and change in time. Particle-resolved models are the only models able to capture this diversity in…

Atmospheric and Oceanic Physics · Physics 2026-01-06 Fabiana Ferracina , Payton Beeler , Mahantesh Halappanavar , Bala Krishnamoorthy , Marco Minutoli , Laura Fierce

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

As an alternative to classical numerical solvers for partial differential equations (PDEs) subject to boundary value constraints, there has been a surge of interest in investigating neural networks that can solve such problems efficiently.…

Machine Learning · Computer Science 2023-08-21 Winfried Lötzsch , Simon Ohler , Johannes S. Otterbach

Advanced deep learning-based approaches have been actively applied to forecast the spatiotemporal physical dynamics governed by partial differential equations (PDEs), which acts as a critical procedure in tackling many science and…

Machine Learning · Computer Science 2026-03-03 Siyang Li , Yize Chen , Yan Guo , Ming Huang , Hui Xiong

Differential equations in general and neural ODEs in particular are an essential technique in continuous-time system identification. While many deterministic learning algorithms have been designed based on numerical integration via the…

Machine Learning · Computer Science 2021-10-18 Lenart Treven , Philippe Wenk , Florian Dörfler , Andreas Krause

Deep learning methods have access to be employed for solving physical systems governed by parametric partial differential equations (PDEs) due to massive scientific data. It has been refined to operator learning that focuses on learning…

Machine Learning · Computer Science 2024-03-06 Chu Wang , Jinhong Wu , Yanzhi Wang , Zhijian Zha , Qi Zhou

This paper introduces an extension of generalised filtering for online applications. Generalised filtering refers to data assimilation schemes that jointly infer latent states, learn unknown model parameters, and estimate uncertainty in an…

Machine Learning · Statistics 2026-05-05 Mehran H. Z. Bazargani , Szymon Urbas , Adeel Razi , Thomas Brendan Murphy , Karl Friston

One of the main challenges in using deep learning-based methods for simulating physical systems and solving partial differential equations (PDEs) is formulating physics-based data in the desired structure for neural networks. Graph neural…

This paper deals with estimating model parameters in graphical models. We reformulate it as an information geometric optimization problem and introduce a natural gradient descent strategy that incorporates additional meta parameters. We…

Machine Learning · Computer Science 2019-05-15 Eric Benhamou , Jamal Atif , Rida Laraki , David Saltiel

Gradient matching with Gaussian processes is a promising tool for learning parameters of ordinary differential equations (ODE's). The essence of gradient matching is to model the prior over state variables as a Gaussian process which…

Machine Learning · Statistics 2016-10-25 Nico S. Gorbach , Stefan Bauer , Joachim M. Buhmann

Synthesizing tabular data is attracting much attention these days for various purposes. With sophisticate synthetic data, for instance, one can augment its training data. For the past couple of years, tabular data synthesis techniques have…

Machine Learning · Computer Science 2021-06-01 Jayoung Kim , Jinsung Jeon , Jaehoon Lee , Jihyeon Hyeong , Noseong Park