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Graph neural networks (GNNs) have become a core paradigm for learning on relational data. In materials science, equivariant GNNs (EGNNs) have emerged as a compelling backbone for crystalline-structure prediction, owing to their ability to…

Machine Learning · Computer Science 2025-10-08 Yang Cao , Zhao Song , Jiahao Zhang , Jiale Zhao

We give a short, self-contained, and easily verifiable proof that determining the outerthickness of a general graph is NP-hard. This resolves a long-standing open problem on the computational complexity of outerthickness. Moreover, our…

Computational Complexity · Computer Science 2026-02-10 Pin-Hsian Lee , Te-Cheng Liu , Meng-Tsung Tsai

We study the problem of recovering a globally consistent Euclidean embedding of data, given only a local distance graph and propose a method that optimally represents these distances. The method operates solely on a neighborhood graph…

Machine Learning · Computer Science 2026-05-20 Dimitris Arabadjis

Given a finite non-decreasing sequence $d=(d_1,\ldots,d_n)$ of natural numbers, the Graph Realization problem asks whether $d$ is a graphic sequence, i.e., there exists a labeled simple graph such that $(d_1,\ldots,d_n)$ is the degree…

Graph Neural Networks (GNNs) have emerged as formidable resources for processing graph-based information across diverse applications. While the expressive power of GNNs has traditionally been examined in the context of graph-level tasks,…

Machine Learning · Computer Science 2025-03-12 A. Martina Neuman , Rongrong Wang , Yuying Xie

Let $G$ be a graph with vertex set $V(G)$. Let $n$ and $k$ be non-negative integers such that $n + 2k \leq |V(G)| - 2$ and $|V(G)| - n$ is even. If when deleting any $n$ vertices of $G$ the remaining subgraph contains a matching of $k$…

Combinatorics · Mathematics 2007-05-23 Guizhen Liu , Qinglin Yu

The ability to compute similarity scores between graphs based on metrics such as Graph Edit Distance (GED) is important in many real-world applications. Computing exact GED values is typically an NP-hard problem and traditional algorithms…

Machine Learning · Computer Science 2022-08-18 Haoyan Xu , Runjian Chen , Yueyang Wang , Ziheng Duan , Jie Feng

The definition of $1$-planar graphs naturally extends graph planarity, namely a graph is $1$-planar if it can be drawn in the plane with at most one crossing per edge. Unfortunately, while testing graph planarity is solvable in linear time,…

Computational Geometry · Computer Science 2019-11-05 Carla Binucci , Walter Didimo , Fabrizio Montecchiani

Graph Edit Distance (GED) is defined as the minimum cost transformation of one graph into another and is a widely adopted metric for measuring the dissimilarity between graphs. The major problem of GED is that its computation is NP-hard,…

Machine Learning · Computer Science 2026-02-24 Francesco Leonardi , Markus Orsi , Jean-Louis Reymond , Kaspar Riesen

Recent research has shown that alignment between the structure of graph data and the geometry of an embedding space is crucial for learning high-quality representations of the data. The uniform geometry of Euclidean and hyperbolic spaces…

Machine Learning · Computer Science 2023-06-27 Wei Zhao , Federico Lopez , J. Maxwell Riestenberg , Michael Strube , Diaaeldin Taha , Steve Trettel

Let $G=(V,E)$ be a simple undirected graph. The open neighbourhood of a vertex $v$ in $G$ is defined as $N_G(v)=\{u\in V~|~ uv\in E\}$; whereas the closed neighbourhood is defined as $N_G[v]= N_G(v)\cup \{v\}$. For an integer $k$, a subset…

Combinatorics · Mathematics 2023-10-12 Debojyoti Bhattacharya , Subhabrata Paul

Recently, one has seen a surge of interest in developing such methods including ones for learning such representations for (undirected) graphs (while preserving important properties). However, most of the work to date on embedding graphs…

Social and Information Networks · Computer Science 2018-11-30 Jiankai Sun , Srinivasan Parthasarathy

A map $f\colon K\to \mathbb R^d$ of a simplicial complex is an almost embedding if $f(\sigma)\cap f(\tau)=\emptyset$ whenever $\sigma,\tau$ are disjoint simplices of $K$. Theorem. Fix integers $d,k\ge2$ such that $d=\frac{3k}2+1$. (a)…

Geometric Topology · Mathematics 2020-10-27 Arkadiy Skopenkov , Martin Tancer

We establish a geometric framework by transforming a graph $G$ into a $(d-1)$-dimensional CW complex $U^{d-1}(G)$. This construction is achieved by systematically attaching $i$-spheres ($2 \le i \le d-1$) to $G$ according to specific rules,…

Combinatorics · Mathematics 2026-03-13 Qiming Fang , Sihong Shao

Scheinerman and Wilf (1994) assert that `an important open problem in the study of graph embeddings is to determine the rectilinear crossing number of the complete graph K_n.' A rectilinear drawing of K_n is an arrangement of n vertices in…

Discrete Mathematics · Computer Science 2011-10-04 Alex Brodsky , Stephane Durocher , Ellen Gethner

A uniformly discrete Euclidean graph is a graph embedded in a Euclidean space so that there is a minimum distance between distinct vertices. If such a graph embedded in an $n$-dimensional space is preserved under $n$ linearly independent…

Combinatorics · Mathematics 2016-11-09 Gregory McColm

A survey of enumeration problems arising from the study of graphs formed when the edges of a polygon are marked with evenly spaced points and every pair of points is joined by a line. A few of these problems have been solved, a classical…

Combinatorics · Mathematics 2020-12-24 Lars Blomberg , Scott R. Shannon , N. J. A. Sloane

Although there are very algorithms for embedding graphs on unbounded grids, only few results on embedding or drawing graphs on restricted grids has been published. In this work, we consider the problem of embedding paths and cycles on grid…

Discrete Mathematics · Computer Science 2014-10-10 Asghar Asgharian Sardroud , Alireza Bagheri

Graph Edit Distance (GED) is a fundamental, albeit NP-hard, metric for structural graph similarity. Recent neural graph matching architectures approximate GED by first encoding graphs with a Graph Neural Network (GNN) and then applying…

Machine Learning · Computer Science 2026-05-08 Jyotirmaya Shivottam , Subhankar Mishra

Most Graph Neural Networks (GNNs) cannot distinguish some graphs or indeed some pairs of nodes within a graph. This makes it impossible to solve certain classification tasks. However, adding additional node features to these models can…

Machine Learning · Computer Science 2022-09-20 Beni Egressy , Roger Wattenhofer
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