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Given a simple connected undirected graph G, the Wiener index W(G) of G is defined as half the sum of the distances over all pairs of vertices of G. In practice, G corresponds to what is known as the molecular graph of an organic compound.…

Discrete Mathematics · Computer Science 2010-12-13 R. Balakrishnan , N. Sridharan , K. V. Iyer

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

We study a graph parameter related to resolving sets and metric dimension, namely the resolving number, introduced by Chartrand, Poisson and Zhang. First, we establish an important difference between the two parameters: while computing the…

Combinatorics · Mathematics 2013-09-03 Delia Garijo , Antonio González , Alberto Márquez

Topological indices play a significant role in mathematical chemistry. Given a graph $\mathcal{G}$ with vertex set $\mathcal{V}=\{1,2,\dots,n\}$ and edge set $\mathcal{E}$, let $d_i$ be the degree of node $i$. The degree-based topological…

Combinatorics · Mathematics 2023-10-09 Mingao Yuan

A vertex $x$ in a graph $G$ resolves two vertices $u$, $v$ of $G$ if the distance between $u$ and $x$ is not equal to the distance between $v$ and $x$. A function $g$ from the vertex set of $G$ to $[0,1]$ is a resolving function of $G$ if…

Combinatorics · Mathematics 2015-03-13 Min Feng , Kaishun Wang

The resolvent energy of a graph $G$ of order $n$ is defined as $ER=\sum_{i=1}^n (n-\lambda_i)^{-1}$, where $\lambda_1,\lambda_2,\ldots,\lambda_n$ are the eigenvalues of $G$. In a recent work [Gutman et al., {\it MATCH Commun. Math. Comput.…

Combinatorics · Mathematics 2015-12-31 Luiz Emilio Allem , Juliane Capaverde , Vilmar Trevisan , Ivan Gutman , Emir Zogić , Edin Glogić

Graph theory has provided a very useful tool, called topological indices which are a number obtained from the graph $G$ with the property that every graph $H$ isomorphic to $G$, value of a topological index must be same for both $G$ and…

Combinatorics · Mathematics 2017-10-06 Nilanjan De

The paper discusses the edge hyper-Zagreb index of a graph, which is calculated by replacing vertex degrees with edge degrees. The degree of an edge is determined by adding up the degrees of the end vertices of the edge and subtracting 2.…

General Mathematics · Mathematics 2024-06-26 Z. Aliannejadi , S. Shafiee Alamoti

Given a graph $G$, the number of its vertices is represented by $n(G)$, while the number of its edges is denoted as $m(G)$. An independent set in a graph is a set of vertices where no two vertices are adjacent to each other and the size of…

Combinatorics · Mathematics 2023-08-04 Ohr Kadrawi , Vadim E. Levit

A resolving set for a graph $\Gamma$ is a collection of vertices $S$, chosen so that for each vertex $v$, the list of distances from $v$ to the members of $S$ uniquely specifies $v$. The metric dimension $\mu(\Gamma)$ is the smallest size…

Combinatorics · Mathematics 2023-03-15 Robert F. Bailey , Pablo Spiga

In the paper we develop new methods for calculating the two well-known topological indices, the degree-distance and the Gutman index. Firstly, we prove that the Wiener index of a double vertex-weighted graph can be computed from the Wiener…

Combinatorics · Mathematics 2019-04-09 Simon Brezovnik , Niko Tratnik

Graph neural networks have recently become a standard method for analysing chemical compounds. In the field of molecular property prediction, the emphasis is now put on designing new model architectures, and the importance of atom…

Chemical Physics · Physics 2021-02-15 Agnieszka Pocha , Tomasz Danel , Łukasz Maziarka

Let ${\rm dim}(G)$ and $D(G)$ respectively denote the metric dimension and the distinguishing number of a graph $G$. It is proved that $D(G) \le {\rm dim}(G)+1$ holds for every connected graph $G$. Among trees, exactly paths and stars…

Combinatorics · Mathematics 2025-07-08 Meysam Korivand , Nasrin Soltankhah , Sandi Klavžar

Let G be a simple connected graph having vertex set V and edge set E. The vertex-set and edge-set of G denoted by V(G) and E(G), respectively. The length of the smallest path between two vertices is called the distance. Mathematical…

The atom-bond connectivity (ABC) index is a well-known degree-based molecular structure descriptor with a variety of chemical applications. In 2010 Graovac and Ghorbani introduced a distance-based analog of this index, the Graovac-Ghorbani…

Combinatorics · Mathematics 2016-09-07 Darko Dimitrov , Barbara Ikica , Riste Škrekovski

Let $X$ be a finite, simple graph with vertex set $V(X)$. The $2$-distance graph $T_2(X)$ of $X$ is the graph with the same vertex set as $X$ and two vertices are adjacent if and only if their distance in $X$ is exactly $2$. A graph $G$ is…

Combinatorics · Mathematics 2015-10-06 Ramuel P. Ching , I. J. L. Garces

The numerical values extracted from a graph that indicates its topology are called topological indices. A contemporary and efficient method is to compute a graph's topological indices using the graph polynomial that corresponds to it. This…

Discrete Mathematics · Computer Science 2026-02-18 Jayjit Barman , Shibsankar Das

We consider complete graphs with edge weights and/or node weights taking values in some set. In the first part of this paper, we show that a large number of graphs are completely determined, up to isomorphism, by the distribution of their…

Combinatorics · Mathematics 2007-10-11 Mireille Boutin , Gregor Kemper

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. The neighbourhood corona of…

Combinatorics · Mathematics 2016-06-14 Saeid Alikhani , Samaneh Soltani

This work addresses a modification of the random geometric graph (RGG) model by considering a set of points uniformly and independently distributed on the surface of a $(d-1)$-sphere with radius $r$ in a $d-$dimensional Euclidean space,…

Physics and Society · Physics 2018-10-03 Alfonso Allen-Perkins