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Graph Neural Networks (GNNs) have become essential in high-stakes domains such as drug discovery, yet their black-box nature remains a significant barrier to trustworthiness. While self-explainable GNNs attempt to bridge this gap, they…

Machine Learning · Computer Science 2026-02-25 Chuqin Geng , Li Zhang , Haolin Ye , Ziyu Zhao , Yuhe Jiang , Tara Saba , Xinyu Wang , Xujie Si

We present a succinct data structure for permutation graphs, and their superclass of circular permutation graphs, i.e., data structures using optimal space up to lower order terms. Unlike concurrent work on circle graphs (Acan et al. 2022),…

Data Structures and Algorithms · Computer Science 2022-09-27 Konstantinos Tsakalidis , Sebastian Wild , Viktor Zamaraev

Recent advancements in graph-based analysis and solutions of instantly decodable network coding (IDNC) trigger the interest to extend them to more complicated opportunistic network coding (ONC) scenarios, with limited increase in…

Information Theory · Computer Science 2015-05-12 Sameh Sorour , Neda Aboutorab , Parastoo Sadeghi , Tareq Y. Al-Naffouri , Mohamed-Slim Alouini

Recent advances in graph convolutional networks have significantly improved the performance of chemical predictions, raising a new research question: "how do we explain the predictions of graph convolutional networks?" A possible approach…

Machine Learning · Computer Science 2018-07-06 Hirotaka Akita , Kosuke Nakago , Tomoki Komatsu , Yohei Sugawara , Shin-ichi Maeda , Yukino Baba , Hisashi Kashima

Graph is an important data representation which appears in a wide diversity of real-world scenarios. Effective graph analytics provides users a deeper understanding of what is behind the data, and thus can benefit a lot of useful…

Artificial Intelligence · Computer Science 2018-02-05 Hongyun Cai , Vincent W. Zheng , Kevin Chen-Chuan Chang

Many multivariate data such as social and biological data exhibit complex dependencies that are best characterized by graphs. Unlike sequential data, graphs are, in general, unordered structures. This means we can no longer use classic,…

Information Theory · Computer Science 2021-10-05 Mojtaba Abolfazli , Anders Host-Madsen , June Zhang , Andras Bratincsak

Subgraph queries also known as subgraph isomorphism search is a fundamental problem in querying graph-like structured data. It consists to enumerate the subgraphs of a data graph that match a query graph. This problem arises in many…

Databases · Computer Science 2018-07-11 C. Nabti , T. Mecharnia , S. E. Boukhetta , H. Seba , K. Amrouche

We present the graph-based molecule software Molassembler for building organic and inorganic molecules. Molassembler provides algorithms for the construction of molecules built from any set of elements from the periodic table. In…

Chemical Physics · Physics 2022-05-12 Jan-Grimo Sobez , Markus Reiher

Fractional graph isomorphism is the linear relaxation of an integer programming formulation of graph isomorphism. It preserves some invariants of graphs, like degree sequences and equitable partitions, but it does not preserve others like…

Combinatorics · Mathematics 2020-08-20 Flavia Bonomo-Braberman , Dora Tilli

Node classification and graph classification are two graph learning problems that predict the class label of a node and the class label of a graph respectively. A node of a graph usually represents a real-world entity, e.g., a user in a…

Computer Vision and Pattern Recognition · Computer Science 2019-04-11 Jia Li , Yu Rong , Hong Cheng , Helen Meng , Wenbing Huang , Junzhou Huang

Given a graph G and the desired size k in bits, how can we summarize G within k bits, while minimizing the information loss? Large-scale graphs have become omnipresent, posing considerable computational challenges. Analyzing such large…

Databases · Computer Science 2021-02-23 Kyuhan Lee , Hyeonsoo Jo , Jihoon Ko , Sungsu Lim , Kijung Shin

Graph representation learning (GRL) has emerged as a powerful technique for solving graph analytics tasks. It can effectively convert discrete graph data into a low-dimensional space where the graph structural information and graph…

Social and Information Networks · Computer Science 2023-09-21 Chunyu Miao , Chenxuan Xie , Jiajun Zhou , Shanqing Yu , Lina Chen , Qi Xuan

Graph learning from data represents a canonical problem that has received substantial attention in the literature. However, insufficient work has been done in incorporating prior structural knowledge onto the learning of underlying…

Machine Learning · Statistics 2019-04-23 Sandeep Kumar , Jiaxi Ying , José Vinícius de M. Cardoso , Daniel Palomar

Let G be an arbitrary finite weighted digraph with weights in the set of complex rational functions. A general procedure is proposed which allows for the reduction of G to a smaller graph with a less complicated structure having the same…

Combinatorics · Mathematics 2009-11-12 Leonid Bunimovich , Benjamin Webb

Cycles are fundamental elements in graph-structured data and have demonstrated their effectiveness in enhancing graph learning models. To encode such information into a graph learning framework, prior works often extract a summary quantity,…

Machine Learning · Computer Science 2023-12-01 Zuoyu Yan , Tengfei Ma , Liangcai Gao , Zhi Tang , Chao Chen , Yusu Wang

The graph isomorphism, subgraph isomorphism, and graph edit distance problems are combinatorial problems with many applications. Heuristic exact and approximate algorithms for each of these problems have been developed for different kinds…

Logic in Computer Science · Computer Science 2019-11-27 Sheung Chi Chan , James Cheney

In this paper, we propose an end-to-end graph learning framework, namely Deep Iterative and Adaptive Learning for Graph Neural Networks (DIAL-GNN), for jointly learning the graph structure and graph embeddings simultaneously. We first cast…

Machine Learning · Computer Science 2019-12-18 Yu Chen , Lingfei Wu , Mohammed J. Zaki

A graph is a mathematical object consisting of a set of vertices and a set of edges connecting vertices. Graphs can be drawn on paper in various ways, but until recently all published methods of drawing graphs have had undesirable…

Human-Computer Interaction · Computer Science 2014-05-22 Bob Blakley , G R Blakley , Sean M Blakley

Graph code is a linear code obtained from linear codes $C$ and a certain bipartite graph G. In this paper, I propose an expansion of the definition of graph code to general $l$-partite, and give its lower bound of minimum distance. I also…

Combinatorics · Mathematics 2025-01-27 Naoki Fujii

A graph $G$ with vertex set $V(G)$ and edge set $E(G)$ is said to be word-representable if there exists a word $w$ over the alphabet $V(G)$ such that, for any two distinct letters $x,y \in V(G)$, the letters $x$ and $y$ alternate in $w$ if…

Combinatorics · Mathematics 2026-04-14 Eshwar Srinivasan , Ramesh Hariharasubramanian