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The enumeration of chemical graphs is an important topic in cheminformatics and bioinformatics, particularly in the discovery of novel drugs. These graphs are typically either tree-like multigraphs or composed of tree-like multigraphs…

Discrete Mathematics · Computer Science 2025-02-11 Muhammad Ilyas , Seemab Hayat , Naveed Ahmed Azam

Enumerating chemical graphs satisfying given constraints is a fundamental problem in mathematical and computational chemistry, and plays an essential part in a recently proposed framework for the inverse QSAR/QSPR. In this paper,…

Data Structures and Algorithms · Computer Science 2020-04-21 Kyousuke Yamashita , Ryuji Masui , Xiang Zhou , Chenxi Wang , Aleksandar Shurbevski , Hiroshi Nagamochi , Tatsuya Akutsu

We apply the power-of-two-choices paradigm to a random walk on a graph: rather than moving to a uniform random neighbour at each step, a controller is allowed to choose from two independent uniform random neighbours. We prove that this…

Discrete Mathematics · Computer Science 2023-06-22 Agelos Georgakopoulos , John Haslegrave , Thomas Sauerwald , John Sylvester

To determine that two given undirected graphs are isomorphic, we construct for them auxiliary graphs, using the breadth-first search. This makes capability to position vertices in each digraph with respect to each other. If the given graphs…

Data Structures and Algorithms · Computer Science 2018-02-13 Anatoly D. Plotnikov

The Longest Path Problem is a question of finding the maximum length between pairs of vertices of a graph. In the general case, the problem is NP-complete. However, there is a small collection of graph classes for which there exists an…

Data Structures and Algorithms · Computer Science 2024-08-01 Omar Al - Khazali

In this paper, we investigate the problem of generating the spanning trees of a graph $G$ up to the automorphisms or "symmetries" of $G$. After introducing and surveying this problem for general input graphs, we present algorithms that…

Data Structures and Algorithms · Computer Science 2025-08-20 Mithra Karamchedu , Lucas Bang

A connected graph can be associated with two distinct evolution algebras. In the first case, the structural matrix is the adjacency matrix of the graph itself. In the second case, the structural matrix is the transition probabilities matrix…

Combinatorics · Mathematics 2024-05-22 Paula Cadavid , Mary Luz Rodiño Montoya , Pablo M. Rodriguez , Sebastian J. Vidal

Intersection graphs are well-studied in the area of graph algorithms. Some intersection graph classes are known to have algorithms enumerating all unlabeled graphs by reverse search. Since these algorithms output graphs one by one and the…

Data Structures and Algorithms · Computer Science 2022-12-15 Jun Kawahara , Toshiki Saitoh , Hirokazu Takeda , Ryo Yoshinaka , Yui Yoshioka

Circulant graphs are a widely studied family of graphs whose members possess varying amounts of symmetry. Although considerable progress has been made in finding the automorphism groups of circulant graphs under certain restrictions, a…

Combinatorics · Mathematics 2026-05-15 Sally Cockburn , Ryhory Hatavets , Will Swartz

We automatically verify the crucial steps in the original proof of correctness of an algorithm which, given a geometric graph satisfying certain additional properties removes edges in a systematic way for producing a connected graph in…

Logic in Computer Science · Computer Science 2023-11-30 Lucas Böltz , Viorica Sofronie-Stokkermans , Hannes Frey

We extend the notion of nonbacktracking walks from unweighted graphs to graphs whose edges have a nonnegative weight. Here the weight associated with a walk is taken to be the product over the weights along the individual edges. We give two…

Combinatorics · Mathematics 2024-01-22 Francesca Arrigo , Desmond J. Higham , Vanni Noferini , Ryan Wood

Determining whether two graphs are structurally identical is a fundamental problem with applications spanning mathematics, computer science, chemistry, and network science. Despite decades of study, graph isomorphism remains a challenging…

Computational Physics · Physics 2026-04-10 Sara Najem , Amer E. Mouawad

The 1-2-3 Conjecture, introduced by Karo\'nski, {\L}uczak, and Thomason in 2004, was recently solved by Keusch. This implies that, for any connected graph $G$ different from $K_2$, we can turn $G$ into a locally irregular multigraph $M(G)$,…

Discrete Mathematics · Computer Science 2025-06-27 Julien Bensmail , Romain Bourneuf , Paul Colinot , Samuel Humeau , Timothée Martinod

Evolution algebras are non-associative algebras inspired from biological phenomena, with applications to or connections with different mathematical fields. There are two natural ways to define an evolution algebra associated to a given…

Rings and Algebras · Mathematics 2019-01-01 Paula Cadavid , Mary Luz Rodiño Montoya , Pablo M. Rodríguez

We say that a vertex $v$ in a connected graph $G$ is decisive if the numbers of walks from $v$ of each length determine the graph $G$ rooted at $v$ up to isomorphism among all connected rooted graphs with the same number of vertices. On the…

Discrete Mathematics · Computer Science 2024-10-24 Frank Fuhlbrück , Johannes Köbler , Oleg Verbitsky , Maksim Zhukovskii

A tuple (s1,t1,s2,t2) of vertices in a simple undirected graph is 2-linked when there are two vertex-disjoint paths respectively from s1 to t1 and s2 to t2. A graph is 2-linked when all such tuples are 2-linked. We give a new and simple…

Data Structures and Algorithms · Computer Science 2025-08-15 Samuel Humeau , Damien Pous

We describe two BQP-complete problems concerning properties of sparse graphs having a certain symmetry. The graphs are specified by efficiently computable functions which output the adjacent vertices for each vertex. Let i and j be two…

Quantum Physics · Physics 2007-05-23 Dominik Janzing , Pawel Wocjan

Learning-based methods for routing have gained significant attention in recent years, both in single-objective and multi-objective contexts. Yet, existing methods are unsuitable for routing on multigraphs, which feature multiple edges with…

Machine Learning · Computer Science 2026-02-23 Filip Rydin , Attila Lischka , Jiaming Wu , Morteza Haghir Chehreghani , Balázs Kulcsár

We study the polyhedral properties of three problems of constructing an optimal complete bipartite subgraph (a biclique) in a bipartite graph. In the first problem we consider a balanced biclique with the same number of vertices in both…

Combinatorics · Mathematics 2018-02-16 Vladimir Bondarenko , Andrei Nikolaev , Dzhambolet Shovgenov

We address the correspondence search problem among multiple graphs with complex properties while considering the matching consistency. We describe each pair of graphs by combining multiple attributes, then jointly match them in a unified…

Computer Vision and Pattern Recognition · Computer Science 2018-03-16 Han-Mu Park , Kuk-Jin Yoon