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Solving partial differential equations (PDEs) efficiently and accurately remains a cornerstone challenge in science and engineering, especially for problems involving complex geometries and limited labeled data. We introduce a Physics- and…

Machine Learning · Computer Science 2025-08-14 Subhankar Sarkar , Souvik Chakraborty

Forecasting over graph-structured sensor networks demands models that capture both deterministic spatial trends and stochastic variability, while remaining efficient enough for repeated inference as new observations arrive. We propose…

Machine Learning · Computer Science 2026-04-02 Hanlin Dong , Arian Prabowo , Hao Xue , Ao Shuang , Tianyi Zhou , Flora D. Salim

The ability of Graph Neural Networks (GNNs) to capture long-range and global topology information is limited by the scope of conventional graph Laplacian, leading to unsatisfactory performance on some datasets, particularly on heterophilic…

Machine Learning · Computer Science 2024-09-17 Qincheng Lu , Jiaqi Zhu , Sitao Luan , Xiao-Wen Chang

The challenge of effectively learning inter-series correlations for multivariate time series forecasting remains a substantial and unresolved problem. Traditional deep learning models, which are largely dependent on the Transformer paradigm…

Machine Learning · Computer Science 2024-05-29 Wanlin Cai , Kun Wang , Hao Wu , Xiaoxu Chen , Yuankai Wu

Neural operators learn to map initial conditions to the terminal solution of partial differential equations (PDEs), providing a surrogate for the full operator mapping. This enables rapid prediction across different input configurations.…

Machine Learning · Computer Science 2026-05-14 Runlong Xie , An Luo

Neural Operators (NOs) are a leading method for surrogate modeling of partial differential equations. Unlike traditional neural networks, which approximate individual functions, NOs learn the mappings between function spaces. While NOs have…

Astrophysics of Galaxies · Physics 2025-08-01 Keith Poletti , Stella S. R. Offner , Rachel A. Ward

While tumor dynamic modeling has been widely applied to support the development of oncology drugs, there remains a need to increase predictivity, enable personalized therapy, and improve decision-making. We propose the use of Tumor Dynamic…

Quantitative Methods · Quantitative Biology 2023-10-24 Mark Laurie , James Lu

Predicting scene dynamics from visual observations is challenging. Existing methods capture dynamics only within observed boundaries failing to extrapolate far beyond the training sequence. Node-RF (Neural ODE-based NeRF) overcomes this…

Computer Vision and Pattern Recognition · Computer Science 2026-03-16 Hiran Sarkar , Liming Kuang , Yordanka Velikova , Benjamin Busam

Time-periodic quantum systems exhibit a rich variety of far-from-equilibrium phenomena and serve as ideal platforms for quantum engineering and control. However, simulating their dynamics with conventional numerical methods remains…

Quantum Physics · Physics 2025-09-10 Zihao Qi , Yang Peng , Christopher Earls

We present a novel model Graph Neural Stochastic Differential Equations (Graph Neural SDEs). This technique enhances the Graph Neural Ordinary Differential Equations (Graph Neural ODEs) by embedding randomness into data representation using…

Machine Learning · Computer Science 2023-08-25 Richard Bergna , Felix Opolka , Pietro Liò , Jose Miguel Hernandez-Lobato

We introduce ODE-GS, a novel approach that integrates 3D Gaussian Splatting with latent neural ordinary differential equations (ODEs) to enable future extrapolation of dynamic 3D scenes. Unlike existing dynamic scene reconstruction methods,…

Graphics · Computer Science 2026-04-28 Daniel Wang , Patrick Rim , Tian Tian , Dong Lao , Alex Wong , Ganesh Sundaramoorthi

Spatio-temporal process models are often used for modeling dynamic physical and biological phenomena that evolve across space and time. These phenomena may exhibit environmental heterogeneity and complex interactions that are difficult to…

Methodology · Statistics 2026-01-06 Pratik Nag , Andrew Zammit-Mangion , Sumeetpal Singh , Noel Cressie

Neural networks with physics based inductive biases such as Lagrangian neural networks (LNN), and Hamiltonian neural networks (HNN) learn the dynamics of physical systems by encoding strong inductive biases. Alternatively, Neural ODEs with…

Machine Learning · Computer Science 2024-06-18 Suresh Bishnoi , Ravinder Bhattoo , Sayan Ranu , N. M. Anoop Krishnan

Recent advancements in Spatiotemporal Graph Neural Networks (ST-GNNs) and Transformers have demonstrated promising potential for traffic forecasting by effectively capturing both temporal and spatial correlations. The generalization ability…

Machine Learning · Computer Science 2024-10-02 Hongjun Wang , Jiyuan Chen , Tong Pan , Zheng Dong , Lingyu Zhang , Renhe Jiang , Xuan Song

Operator learning has emerged as a promising paradigm for developing efficient surrogate models to solve partial differential equations (PDEs). However, existing approaches often overlook the domain knowledge inherent in the underlying PDEs…

Machine Learning · Computer Science 2025-10-20 Ziqian Li , Kang Liu , Yongcun Song , Hangrui Yue , Enrique Zuazua

Geological carbon sequestration (GCS) involves injecting CO$_2$ into subsurface geological formations for permanent storage. Numerical simulations could guide decisions in GCS projects by predicting CO$_2$ migration pathways and the…

Machine Learning · Computer Science 2024-09-26 Jonathan E. Lee , Min Zhu , Ziqiao Xi , Kun Wang , Yanhua O. Yuan , Lu Lu

Memory complexity and data scarcity have so far prohibited learning solution operators of partial differential equations (PDEs) at high resolutions. We address these limitations by introducing a new data efficient and highly parallelizable…

Machine Learning · Computer Science 2023-10-03 Jean Kossaifi , Nikola Kovachki , Kamyar Azizzadenesheli , Anima Anandkumar

Knowledge Graph Embeddings (KGEs) have shown promising performance on link prediction tasks by mapping the entities and relations from a knowledge graph into a geometric space (usually a vector space). Ultimately, the plausibility of the…

Machine Learning · Computer Science 2020-10-20 Mojtaba Nayyeri , Chengjin Xu , Jens Lehmann , Sahar Vahdati

We introduce the framework of continuous--depth graph neural networks (GNNs). Graph neural ordinary differential equations (GDEs) are formalized as the counterpart to GNNs where the input-output relationship is determined by a continuum of…

Machine Learning · Computer Science 2021-06-23 Michael Poli , Stefano Massaroli , Junyoung Park , Atsushi Yamashita , Hajime Asama , Jinkyoo Park

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…