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To alleviate the local receptive issue of GCN, Transformers have been exploited to capture the long range dependences of nodes for graph data representation and learning. However, existing graph Transformers generally employ regular…

机器学习 · 计算机科学 2023-05-15 Bo Jiang , Fei Xu , Ziyan Zhang , Jin Tang , Feiping Nie

Graph neural networks (GNNs) are the primary tool for processing graph-structured data. Unfortunately, the most commonly used GNNs, called Message Passing Neural Networks (MPNNs) suffer from several fundamental limitations. To overcome…

机器学习 · 计算机科学 2022-11-11 Sohir Maskey , Ali Parviz , Maximilian Thiessen , Hannes Stärk , Ylli Sadikaj , Haggai Maron

Graph machine learning methods excel at leveraging pairwise relations present in the data. However, graphs are unable to fully capture the multi-way interactions inherent in many complex systems. An effective way to incorporate them is to…

Graph Neural Networks (GNNs) and Transformers share significant similarities in their encoding strategies for interacting with features from nodes of interest, where Transformers use query-key scores and GNNs use edges. Compared to GNNs,…

机器学习 · 计算机科学 2025-07-08 Jiaxin Qi , Yan Cui , Jinli Ou , Jianqiang Huang , Gaogang Xie

Centrality describes the importance of nodes in a graph and is modeled by various measures. Its global analogue, called centralization, is a general formula for calculating a graph-level centrality score based on the node-level centrality…

社会与信息网络 · 计算机科学 2022-05-03 Jose Mari E. Ortega , Rolito G. Eballe

In graph neural networks (GNNs), both node features and labels are examples of graph signals, a key notion in graph signal processing (GSP). While it is common in GSP to impose signal smoothness constraints in learning and estimation tasks,…

信号处理 · 电气工程与系统科学 2023-04-10 Feng Ji , See Hian Lee , Kai Zhao , Wee Peng Tay , Jielong Yang

Graph neural networks (GNNs) model nonlinear representations in graph data with applications in distributed agent coordination, control, and planning among others. Current GNN architectures assume ideal scenarios and ignore link…

信号处理 · 电气工程与系统科学 2021-09-01 Zhan Gao , Elvin Isufi , Alejandro Ribeiro

Accurately simulating physics is crucial across scientific domains, with applications spanning from robotics to materials science. While traditional mesh-based simulations are precise, they are often computationally expensive and require…

机器学习 · 计算机科学 2025-10-23 Philipp Dahlinger , Tai Hoang , Denis Blessing , Niklas Freymuth , Gerhard Neumann

Transformers have recently emerged as powerful neural networks for graph learning, showcasing state-of-the-art performance on several graph property prediction tasks. However, these results have been limited to small-scale graphs, where the…

机器学习 · 计算机科学 2023-12-19 Vijay Prakash Dwivedi , Yozen Liu , Anh Tuan Luu , Xavier Bresson , Neil Shah , Tong Zhao

Graph convolutional networks (GCNs) are a family of neural network models that perform inference on graph data by interleaving vertex-wise operations and message-passing exchanges across nodes. Concerning the latter, two key questions…

机器学习 · 计算机科学 2020-09-29 Indro Spinelli , Simone Scardapane , Aurelio Uncini

Graph Neural Networks (GNNs) are increasingly becoming the favorite method for graph learning. They exploit the semi-supervised nature of deep learning, and they bypass computational bottlenecks associated with traditional graph learning…

机器学习 · 计算机科学 2023-11-08 Mashaan Alshammari , John Stavrakakis , Adel F. Ahmed , Masahiro Takatsuka

Traditional convolutional neural networks are limited to handling Euclidean space data, overlooking the vast realm of real-life scenarios represented as graph data, including transportation networks, social networks, and reference networks.…

机器学习 · 计算机科学 2023-07-04 Xingyu Liu , Juan Chen , Quan Wen

Urban traffic speed prediction aims to estimate the future traffic speed for improving urban transportation services. Enormous efforts have been made to exploit Graph Neural Networks (GNNs) for modeling spatial correlations and temporal…

机器学习 · 计算机科学 2024-06-26 Yicheng Zhou , Pengfei Wang , Hao Dong , Denghui Zhang , Dingqi Yang , Yanjie Fu , Pengyang Wang

Graph Convolutional Networks (GCNs) have achieved impressive performance in a wide variety of areas, attracting considerable attention. The core step of GCNs is the information-passing framework that considers all information from neighbors…

机器学习 · 计算机科学 2022-02-17 Feng Xia , Lei Wang , Tao Tang , Xin Chen , Xiangjie Kong , Giles Oatley , Irwin King

In this paper we establish a bridge between Topological Data Analysis and Geometric Deep Learning, adapting the topological theory of group equivariant non-expansive operators (GENEOs) to act on the space of all graphs weighted on vertices…

组合数学 · 数学 2022-09-27 Faraz Ahmad , Massimo Ferri , Patrizio Frosini

Graph neural networks process information on graphs represented at a given resolution scale. We analyze the effect of using different coarse-grained graph resolutions, obtained through the Laplacian renormalization group theory, on node…

机器学习 · 计算机科学 2025-04-15 Francesco Caso , Giovanni Trappolini , Andrea Bacciu , Pietro Liò , Fabrizio Silvestri

Connection graphs (CGs) extend traditional graph models by coupling network topology with orthogonal transformations, enabling the representation of global geometric consistency. They play a key role in applications such as synchronization,…

机器学习 · 计算机科学 2025-10-14 Leonardo Di Nino , Gabriele D'Acunto , Sergio Barbarossa , Paolo Di Lorenzo

Graph neural networks (GNN) have shown outstanding applications in many fields where data is fundamentally represented as graphs (e.g., chemistry, biology, recommendation systems). In this vein, communication networks comprise many…

Graph Convolutional Networks (GCNs) have become a pivotal method in machine learning for modeling functions over graphs. Despite their widespread success across various applications, their statistical properties (e.g., consistency,…

机器学习 · 计算机科学 2025-04-17 Juntong Chen , Johannes Schmidt-Hieber , Claire Donnat , Olga Klopp

We introduce Attention Graphs, a new tool for mechanistic interpretability of Graph Neural Networks (GNNs) and Graph Transformers based on the mathematical equivalence between message passing in GNNs and the self-attention mechanism in…

机器学习 · 计算机科学 2025-02-26 Batu El , Deepro Choudhury , Pietro Liò , Chaitanya K. Joshi