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Graph neural networks (GNNs) are widely used in graph learning and most architectures propagate information by passing messages between vertices. In this work, we shift our attention to GNNs that perform message passing on edges and…

The ability to detect and count certain substructures in graphs is important for solving many tasks on graph-structured data, especially in the contexts of computational chemistry and biology as well as social network analysis. Inspired by…

机器学习 · 计算机科学 2020-10-30 Zhengdao Chen , Lei Chen , Soledad Villar , Joan Bruna

Graph Neural Networks (GNNs) have emerged as a powerful tool for data-driven learning on various graph domains. They are usually based on a message-passing mechanism and have gained increasing popularity for their intuitive formulation,…

机器学习 · 计算机科学 2023-11-02 Giuseppe Alessio D'Inverno , Simone Brugiapaglia , Mirco Ravanelli

The expressive power of graph neural network formalisms is commonly measured by their ability to distinguish graphs. For many formalisms, the k-dimensional Weisfeiler-Leman (k-WL) graph isomorphism test is used as a yardstick. In this paper…

机器学习 · 计算机科学 2020-07-24 Floris Geerts

Recently, many works studied the expressive power of graph neural networks (GNNs) by linking it to the $1$-dimensional Weisfeiler--Leman algorithm ($1\text{-}\mathsf{WL}$). Here, the $1\text{-}\mathsf{WL}$ is a well-studied heuristic for…

机器学习 · 计算机科学 2023-05-31 Christopher Morris , Floris Geerts , Jan Tönshoff , Martin Grohe

Graph Neural Networks (GNNs) have emerged as prominent models for representation learning on graph structured data. GNNs follow an approach of message passing analogous to 1-dimensional Weisfeiler Lehman (1-WL) test for graph isomorphism…

机器学习 · 计算机科学 2022-03-18 Mohammed Haroon Dupty , Wee Sun Lee

Graph isomorphism testing is usually approached via the comparison of graph invariants. Two popular alternatives that offer a good trade-off between expressive power and computational efficiency are combinatorial (i.e., obtained via the…

机器学习 · 计算机科学 2022-03-03 Or Feldman , Amit Boyarski , Shai Feldman , Dani Kogan , Avi Mendelson , Chaim Baskin

Graph neural networks (GNNs) and message passing neural networks (MPNNs) have been proven to be expressive for subgraph structures in many applications. Some applications in heterogeneous graphs require explicit edge modeling, such as…

机器学习 · 计算机科学 2021-12-17 Xin Liu , Yangqiu Song

Various recent proposals increase the distinguishing power of Graph Neural Networks GNNs by propagating features between $k$-tuples of vertices. The distinguishing power of these "higher-order'' GNNs is known to be bounded by the…

机器学习 · 计算机科学 2021-06-15 Pablo Barceló , Floris Geerts , Juan Reutter , Maksimilian Ryschkov

Graph neural networks (GNNs) have been widely used in graph-related contexts. It is known that the separation power of GNNs is equivalent to that of the Weisfeiler-Lehman (WL) test; hence, GNNs are imperfect at identifying all…

机器学习 · 计算机科学 2025-02-07 Ziang Chen , Qiao Zhang , Runzhong Wang

The expressive power of Graph Neural Networks (GNNs) is often analysed via correspondence to the Weisfeiler-Leman (WL) algorithm and fragments of first-order logic. Standard GNNs are limited to performing aggregation over immediate…

机器学习 · 计算机科学 2026-02-23 Huan Luo , Jonni Virtema

Graph Neural Networks (GNNs) have achieved much success on graph-structured data. In light of this, there have been increasing interests in studying their expressive power. One line of work studies the capability of GNNs to approximate…

机器学习 · 计算机科学 2023-02-14 Zhengdao Chen , Soledad Villar , Lei Chen , Joan Bruna

Graph data, with its structurally variable nature, represents complex real-world phenomena like chemical compounds, protein structures, and social networks. Traditional Graph Neural Networks (GNNs) primarily utilize the message-passing…

机器学习 · 计算机科学 2025-02-05 Jianming Huang , Hiroyuki Kasai

Identifying similar network structures is key to capture graph isomorphisms and learn representations that exploit structural information encoded in graph data. This work shows that ego-networks can produce a structural encoding scheme for…

机器学习 · 计算机科学 2022-12-09 Nurudin Alvarez-Gonzalez , Andreas Kaltenbrunner , Vicenç Gómez

Current GNN architectures use a vertex neighborhood aggregation scheme, which limits their discriminative power to that of the 1-dimensional Weisfeiler-Lehman (WL) graph isomorphism test. Here, we propose a novel graph convolution operator…

机器学习 · 计算机科学 2020-09-22 Clemens Damke , Vitalik Melnikov , Eyke Hüllermeier

We introduce $r$-loopy Weisfeiler-Leman ($r$-$\ell{}$WL), a novel hierarchy of graph isomorphism tests and a corresponding GNN framework, $r$-$\ell{}$MPNN, that can count cycles up to length $r + 2$. Most notably, we show that…

机器学习 · 计算机科学 2024-11-08 Raffaele Paolino , Sohir Maskey , Pascal Welke , Gitta Kutyniok

Recently, subgraphs-enhanced Graph Neural Networks (SGNNs) have been introduced to enhance the expressive power of Graph Neural Networks (GNNs), which was proved to be not higher than the 1-dimensional Weisfeiler-Leman isomorphism test. The…

机器学习 · 计算机科学 2023-01-20 Michele Guerra , Indro Spinelli , Simone Scardapane , Filippo Maria Bianchi

Dynamic Graph Neural Networks (DyGNNs) have garnered increasing research attention for learning representations on evolving graphs. Despite their effectiveness, the limited expressive power of existing DyGNNs hinders them from capturing…

机器学习 · 计算机科学 2024-10-03 Zhe Wang , Tianjian Zhao , Zhen Zhang , Jiawei Chen , Sheng Zhou , Yan Feng , Chun Chen , Can Wang

Graph Neural Networks (GNNs) have demonstrated superior performance on various graph learning tasks, including recommendation, where they leverage user-item collaborative filtering signals in graphs. However, theoretical formulations of…

信息检索 · 计算机科学 2023-09-19 Xuheng Cai , Lianghao Xia , Xubin Ren , Chao Huang

Graph neural networks (GNNs) have achieved tremendous success in graph mining. However, the inability of GNNs to model substructures in graphs remains a significant drawback. Specifically, message-passing GNNs (MPGNNs), as the prevailing…

机器学习 · 计算机科学 2021-04-08 Qingqing Long , Yilun Jin , Yi Wu , Guojie Song