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The Wiener index (i.e., the total distance or the transmission number), defined as the sum of distances between all unordered pairs of vertices in a graph, is one of the most popular molecular descriptors. In this article we summarize some…

Combinatorics · Mathematics 2015-10-06 Martin Knor , Riste Škrekovski , Aleksandra Tepeh

An atom $a$ of a molecular graph $G$ uniquely determines (resolves) a pair $(a_1,a_2)$ of atoms of $G$ if the distance between $a$ and $a_1$ is different from the distance between $a$ and $a_2$. In this paper, we quantify the involvement of…

Combinatorics · Mathematics 2014-08-04 Muhammad Salman , Imran Javaid , Muhammad Anwar Chaudhry

Let $G=(V,E)$ be a finite simple graph. The Graovac-Ghorbani index of a graph G is defined as $ABC_{GG}(G)=\sum_{uv\in E(G)}\sqrt{\frac{n_u(uv,G)+n_v(uv,G)-2}{n_u(uv,G)n_v(uv,G)}},$ where $n_u(uv,G)$ is the number of vertices closer to…

Combinatorics · Mathematics 2022-02-07 Nima Ghanbari

Clustering algorithms for large networks typically use modularity values to test which partitions of the vertex set better represent structure in the data. The modularity of a graph is the maximum modularity of a partition. We consider the…

Combinatorics · Mathematics 2022-12-22 Colin McDiarmid , Fiona Skerman

Topological indices are graph-theoretic descriptors that play a crucial role in mathematical chemistry, capturing the structural characteristics of molecules and enabling the prediction of their physicochemical properties. A widely studied…

Discrete Mathematics · Computer Science 2025-11-26 Sébastien Bonte , Gauvain Devillez , Valentin Dusollier , Alain Hertz , Hadrien Mélot , David Schindl

Using a generating function approach, the correlation coefficients of four different graph-theoretical indices, namely the number of independent vertex subsets, the number of matchings, the number of subtrees and the Wiener index, are…

Combinatorics · Mathematics 2007-05-23 Stephan Wagner

In this paper, we define and compare four new measures of graph irregularity. We use these measures to prove upper bounds for the chromatic number and the Colin de Verdiere parameter. We also strengthen the concise Turan theorem for…

Combinatorics · Mathematics 2014-11-05 Clive Elphick , Pawel Wocjan

The Wiener index of a graph is the sum of the distances between all pairs of vertices, it has been one of the main descriptors that correlate achemical compound's molecular graph with experimentally gathered data regarding the compound's…

Combinatorics · Mathematics 2007-09-12 Hua Wang

In this paper, four novel topological indices named as neighbourhood version of forgotten topological index (F_N), modified neighbourhood version of Forgotten topological index ($F_N^*$), neighbourhood version of second Zagreb index…

Chemical Physics · Physics 2019-06-27 Sourav Mondal , Nilanjan De , Anita Pal

Centrality describes the importance of nodes in a graph and is modeled by various measures. Its global analogue, called centralization, is a general formula for calculating a graph-level centrality score based on the node-level centrality…

Social and Information Networks · Computer Science 2022-05-03 Jose Mari E. Ortega , Rolito G. Eballe

The edge Szeged index of a graph $G$ is defined as $Sz_{e}(G)=\sum\limits_{uv\in E(G)}m_{u}(uv|G)m_{v}(uv|G)$, where $m_{u}(uv|G)$ (resp., $m_{v}(uv|G)$) is the number of edges whose distance to vertex $u$ (resp., $v$) is smaller than the…

Combinatorics · Mathematics 2018-06-06 Shengjie He

The Wiener polarity index of a graph is defined as the number of unordered pairs of vertices at distance three. In recent years, this topological index was extensively studied since it has many known applications in chemistry and also in…

Combinatorics · Mathematics 2019-04-09 Niko Tratnik

The distinguishing number (index) $D(G)$ ($D'(G)$) of a graph $G$ is the least integer $d$ such that $G$ has an vertex labeling (edge labeling) with $d$ labels that is preserved only by a trivial automorphism. In this paper we compute these…

Combinatorics · Mathematics 2016-07-27 Saeid Alikhani , Samaneh Soltani

A vertex-degree-based topological index named as Sombor index of a simple graph G with n vertices was recently introduced by I. Gutman. In this paper, we find Sombor index of m-splitting graph and m-shadow graph. Also, we determine relation…

Combinatorics · Mathematics 2022-05-20 Randhir Singh , S. C. Patekar

We study coherence of graph products and Coxeter groups and obtain many results in this direction.

Group Theory · Mathematics 2018-07-23 Olga Varghese

The $M$-polynomial was introduced by Deutsch and Klav\v{z}ar in 2015 as a graph polynomial to provide an easy way to find closed formulas of degree-based topological indices, which are used to predict physical, chemical, and pharmacological…

Combinatorics · Mathematics 2017-08-29 Abdul Rauf Nizami , Muhammad Idrees , Numan Amin

The aim of this paper is to obtain new sharp inequalities for a large family of topological indices, including the first variable Zagreb index $M_1^\alpha$, and to characterize the set of extremal graphs with respect to them. Our main…

Combinatorics · Mathematics 2018-06-07 Alvaro Martínez-Pérez , José M. Rodríguez

The aim of this paper is to obtain new inequalities for a large family of topological indices restricted to unicyclic graphs and to characterize the set of extremal unicyclic graphs with respect to them. This family includes variable first…

Combinatorics · Mathematics 2021-03-16 Álvaro Martínez-Pérez , José M. Rodríguez

In this paper, we study topological indices in random spiro chains via a martingale approach. In which their explicit analytical expressions of the exact distribution, expected value and variance are obtained. As n goes to infinity, the…

Probability · Mathematics 2022-05-30 Sayle Sigarreta , Sayli Sigarreta , Hugo Cruz-Suarez

In chemical graph theory, caterpillar trees have been an appealing model to represent the molecular structures of benzenoid hydrocarbon. Meanwhile, topological index has been thought of as a powerful tool for modeling quantitative…

Probability · Mathematics 2021-02-26 Panpan Zhang , Xiaojing Wang