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The ubiquity of fluids in the physical world explains the need to accurately simulate their dynamics for many scientific and engineering applications. Traditionally, well established but resource intensive CFD solvers provide such…

机器学习 · 计算机科学 2021-12-21 Lucas Meyer , Louen Pottier , Alejandro Ribes , Bruno Raffin

As urban environments grow, the modelling of transportation systems becomes increasingly complex. This paper advances the field of travel demand modelling by introducing advanced Graph Neural Network (GNN) architectures as surrogate models,…

机器学习 · 计算机科学 2025-03-21 Nikita Makarov , Santhanakrishnan Narayanan , Constantinos Antoniou

Linearized Graph Neural Networks (GNNs) have attracted great attention in recent years for graph representation learning. Compared with nonlinear Graph Neural Network (GNN) models, linearized GNNs are much more time-efficient and can…

机器学习 · 计算机科学 2023-02-02 Yulin Zhu , Xing Ai , Qimai Li , Xiao-Ming Wu , Kai Zhou

In many real world applications, data are characterized by a complex structure, that can be naturally encoded as a graph. In the last years, the popularity of deep learning techniques has renewed the interest in neural models able to…

机器学习 · 计算机科学 2020-04-20 Matteo Tiezzi , Giuseppe Marra , Stefano Melacci , Marco Maggini , Marco Gori

Graph Neural Networks (GNNs) is an architecture for structural data, and has been adopted in a mass of tasks and achieved fabulous results, such as link prediction, node classification, graph classification and so on. Generally, for a…

机器学习 · 计算机科学 2022-05-12 Ye Tang , Xuesong Yang , Xinrui Liu , Xiwei Zhao , Zhangang Lin , Changping Peng

The first provably efficient algorithm for learning graph neural networks (GNNs) with one hidden layer for node information convolution is provided in this paper. Two types of GNNs are investigated, depending on whether labels are attached…

机器学习 · 计算机科学 2020-12-08 Qunwei Li , Shaofeng Zou , Wenliang Zhong

Graph neural networks (GNNs) have achieved great success in many scenarios with graph-structured data. However, in many real applications, there are three issues when applying GNNs: graphs are unknown, nodes have noisy features, and graphs…

机器学习 · 计算机科学 2022-10-11 Yixiang Shan , Jielong Yang , Xing Liu , Yixing Gao , Hechang Chen , Shuzhi Sam Ge

Graph Convolutional Neural Networks (GCNNs) are generalizations of CNNs to graph-structured data, in which convolution is guided by the graph topology. In many cases where graphs are unavailable, existing methods manually construct graphs…

机器学习 · 计算机科学 2019-09-17 Xiang Gao , Wei Hu , Zongming Guo

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…

机器学习 · 计算机科学 2024-06-18 Suresh Bishnoi , Ravinder Bhattoo , Sayan Ranu , N. M. Anoop Krishnan

Graph Neural Networks (GNNs) have demonstrated remarkable success in various applications, yet they often struggle to capture long-range dependencies (LRD) effectively. This paper introduces GraphMinNet, a novel GNN architecture that…

机器学习 · 计算机科学 2025-02-04 Md Atik Ahamed , Andrew Cheng , Qiang Ye , Qiang Cheng

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…

机器学习 · 计算机科学 2022-09-07 Ravinder Bhattoo , Sayan Ranu , N. M. Anoop Krishnan

Recent works have demonstrated the benefits of capturing long-distance dependency in graphs by deeper graph neural networks (GNNs). But deeper GNNs suffer from the long-lasting scalability challenge due to the neighborhood explosion problem…

机器学习 · 计算机科学 2023-06-02 Rui Xue , Haoyu Han , MohamadAli Torkamani , Jian Pei , Xiaorui Liu

Graph Neural Networks (GNNs) have established themselves as the leading models for learning on graph-structured data, generally categorized into spatial and spectral approaches. Central to these architectures is the Graph Shift Operator…

机器学习 · 计算机科学 2026-02-09 Yassine Abbahaddou

Graph neural networks (GNNs) have received massive attention in the field of machine learning on graphs. Inspired by the success of neural networks, a line of research has been conducted to train GNNs to deal with various tasks, such as…

机器学习 · 计算机科学 2022-04-11 Manh Tuan Do , Noseong Park , Kijung Shin

Continuum mechanics simulators, numerically solving one or more partial differential equations, are essential tools in many areas of science and engineering, but their performance often limits application in practice. Recent modern machine…

机器学习 · 计算机科学 2021-06-10 Mario Lino , Chris Cantwell , Anil A. Bharath , Stathi Fotiadis

The simulation of complex physical systems using a discretized mesh is a cornerstone of applied mechanics, but traditional numerical solvers are often computationally prohibitive for many-query tasks. While Graph Neural Networks (GNNs) have…

机器学习 · 计算机科学 2025-09-24 Kangzheng Liu , Leixin Ma

In this paper, we present LiGNN, a deployed large-scale Graph Neural Networks (GNNs) Framework. We share our insight on developing and deployment of GNNs at large scale at LinkedIn. We present a set of algorithmic improvements to the…

Many popular variants of graph neural networks (GNNs) that are capable of handling multi-relational graphs may suffer from vanishing gradients. In this work, we propose a novel GNN architecture based on the Gated Graph Neural Network with…

机器学习 · 计算机科学 2020-07-21 Denis Lukovnikov , Jens Lehmann , Asja Fischer

Linear Graph Convolutional Networks (GCNs) are used to classify the node in the graph data. However, we note that most existing linear GCN models perform neural network operations in Euclidean space, which do not explicitly capture the…

机器学习 · 计算机科学 2024-06-17 Qiuyu Liang , Weihua Wang , Feilong Bao , Guanglai Gao

The analysis of 3D point clouds has diverse applications in robotics, vision and graphics. Processing them presents specific challenges since they are naturally sparse, can vary in spatial resolution and are typically unordered. Graph-based…

计算机视觉与模式识别 · 计算机科学 2023-04-03 Mohammad Khodadad , Morteza Rezanejad , Ali Shiraee Kasmaee , Kaleem Siddiqi , Dirk Walther , Hamidreza Mahyar