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Learning to optimize is a rapidly growing area that aims to solve optimization problems or improve existing optimization algorithms using machine learning (ML). In particular, the graph neural network (GNN) is considered a suitable ML model…

Machine Learning · Computer Science 2023-05-29 Ziang Chen , Jialin Liu , Xinshang Wang , Jianfeng Lu , Wotao Yin

We introduce a connection between a near-term quantum computing device, specifically a Gaussian boson sampler, and the graph isomorphism problem. We propose a scheme where graphs are encoded into quantum states of light, whose properties…

Quantum Physics · Physics 2021-04-08 Kamil Bradler , Shmuel Friedland , Josh Izaac , Nathan Killoran , Daiqin Su

The connection between certain entangled states and graphs has been heavily studied in the context of measurement-based quantum computation as a tool for understanding entanglement. Here we show that this correspondence can be harnessed in…

Quantum Physics · Physics 2016-03-23 Liming Zhao , Carlos A. Pérez-Delgado , Joseph F. Fitzsimons

Graph and network visualization supports exploration, analysis and communication of relational data arising in many domains: from biological and social networks, to transportation and powergrid systems. With the arrival of AI-based…

Graph algorithms play an important role in many computer science areas. In order to solve problems that can be modeled using graphs, it is necessary to use a data structure that can represent those graphs in an efficient manner. On top of…

Mathematical Software · Computer Science 2023-08-22 Cristian Frăsinaru , Emanuel Florentin Olariu

We present a novel approach for graph classification based on tabularizing graph data via new variants of the Weisfeiler-Leman algorithm and then applying methods for tabular data. The variants are obtained by modifying the underlying…

Machine Learning · Computer Science 2026-05-25 Reijo Jaakkola , Tomi Janhunen , Antti Kuusisto , Magdalena Ortiz , Matias Selin , Mantas Šimkus

In modern mathematics, graphs figure as one of the better-investigated class of mathematical objects. Various properties of graphs, as well as graph-processing algorithms, can be useful if graphs of a certain kind are used as denotations…

Logic in Computer Science · Computer Science 2007-05-23 Alex Shkotin

Applied research in graph algorithms and combinatorial structures needs comprehensive and versatile software libraries. However, the design and the implementation of flexible libraries are challenging activities. Among the other problems…

Software Engineering · Computer Science 2007-05-23 Maurizio Pizzonia , Giuseppe Di Battista

Several graph visualization tools exist. However, they are not able to handle large graphs, and/or they do not allow interaction. We are interested on large graphs, with hundreds of thousands of nodes. Such graphs bring two challenges: the…

Social and Information Networks · Computer Science 2015-06-15 Jose Rodrigues , Hanghang Tong , Agma Traina , Christos Faloutsos , Jure Leskovec

Theoretical studies on the representation power of GNNs have been centered around understanding the equivalence of GNNs, using WL-Tests for detecting graph isomorphism. In this paper, we argue that such equivalence ignores the accompanying…

Machine Learning · Computer Science 2024-08-26 P. Krishna Kumar a , Harish G. Ramaswamy

We introduce GraphSL, a new library for studying the graph source localization problem. graph diffusion and graph source localization are inverse problems in nature: graph diffusion predicts information diffusions from information sources,…

Machine Learning · Computer Science 2024-07-30 Junxiang Wang , Liang Zhao

The field of Graph Signal Processing (GSP) has proposed tools to generalize harmonic analysis to complex domains represented through graphs. Among these tools are translations, which are required to define many others. Most works propose to…

Signal Processing · Electrical Eng. & Systems 2022-01-12 Raphael Baena , Lucas Drumetz , Vincent Gripon

The expressivity of Graph Neural Networks (GNNs) has been studied broadly in recent years to reveal the design principles for more powerful GNNs. Graph canonization is known as a typical approach to distinguish non-isomorphic graphs, yet…

Machine Learning · Computer Science 2024-02-12 Zehao Dong , Muhan Zhang , Philip R. O. Payne , Michael A Province , Carlos Cruchaga , Tianyu Zhao , Fuhai Li , Yixin Chen

This work generalizes graph neural networks (GNNs) beyond those based on the Weisfeiler-Lehman (WL) algorithm, graph Laplacians, and diffusions. Our approach, denoted Relational Pooling (RP), draws from the theory of finite partial…

Machine Learning · Computer Science 2019-05-16 Ryan L. Murphy , Balasubramaniam Srinivasan , Vinayak Rao , Bruno Ribeiro

The study of sampling signals on graphs, with the goal of building an analog of sampling for standard signals in the time and spatial domains, has attracted considerable attention recently. Beyond adding to the growing theory on graph…

Signal Processing · Electrical Eng. & Systems 2020-12-02 Yuichi Tanaka , Yonina C. Eldar , Antonio Ortega , Gene Cheung

We present a framework for representing and modeling data on graphs. Based on this framework, we study three typical classes of graph signals: smooth graph signals, piecewise-constant graph signals, and piecewise-smooth graph signals. For…

Artificial Intelligence · Computer Science 2015-12-18 Siheng Chen , Rohan Varma , Aarti Singh , Jelena Kovačević

Recently, Graph Neural Networks (GNNs) have greatly advanced the task of graph classification. Typically, we first build a unified GNN model with graphs in a given training set and then use this unified model to predict labels of all the…

Machine Learning · Computer Science 2021-12-15 Yiqi Wang , Yao Ma , Wei Jin , Chaozhuo Li , Charu Aggarwal , Jiliang Tang

Graphs are used in many disciplines to model the relationships that exist between objects in a complex discrete system. Researchers may wish to compare a network of interest to a "typical" graph from a family (or ensemble) of graphs which…

Combinatorics · Mathematics 2025-08-08 Catherine Greenhill

In enumerative combinatorics, it is often a goal to enumerate both labeled and unlabeled structures of a given type. The theory of combinatorial species is a novel toolset which provides a rigorous foundation for dealing with the…

Combinatorics · Mathematics 2013-12-03 Andy Hardt , Pete McNeely , Tung Phan , Justin M. Troyka

In recent years, a wide variety of graph neural network (GNN) architectures have emerged, each with its own strengths, weaknesses, and complexities. Various techniques, including rewiring, lifting, and node annotation with centrality…

Machine Learning · Computer Science 2024-10-14 Zhifei Li , Gerrit Großmann , Verena Wolf