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Topological indices are graph invariants numeric quantities, which are utilized by researchers to analyze a variety of physiochemical aspects of molecules. The goal of developing topological indices is to give each chemical structure a…

组合数学 · 数学 2022-12-09 Sohan Lal , Karnika Sharma , Vijay Kumar Bhat

A topological index is a real number which is derived from a network or a graph by mathematically that characterizes the whole of its structural properties. Recently, there are various topological indices that have been introduced in…

组合数学 · 数学 2019-04-23 Prosanta Sarkar , Nilanjan De , Anita Pal

In this paper, we examine a specific type of random chains and propose an unified approach to studying the degree-based topological indices, including their extreme values. We derive explicit analytical expressions for the expected values…

概率论 · 数学 2024-11-08 Sayle Sigarreta , Hugo Cruz-Suarez , Sergio Torralbas Fitz

There are various topological indices such as degree based topological indices, distance based topological indices and counting related topological indices etc. These topological indices correlate certain physicochemical properties such as…

组合数学 · 数学 2016-05-09 Shaohui Wang , Jia-Bao Liu , Chunxiang Wang , Sakander Hayat

Making use of a majorization technique for a suitable class of graphs, we derive upper and lower bounds for some topological indices depending on the degree sequence over all vertices, namely the first general Zagreb index and the first…

组合数学 · 数学 2015-03-27 Monica Bianchi , Alessandra Cornaro , José Luis Palacios , Anna Torriero

Applications in chemistry motivated mathematicians to define different topological indices for different types of graphs. The Hyper-Zagreb index (HM) is an important tool as it integrates the first and the second Zagreb indices. In this…

组合数学 · 数学 2018-09-12 Hassan Rezapour , Ramin Nasiri , Seyedahmad Mousavi

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…

化学物理 · 物理学 2019-06-27 Sourav Mondal , Nilanjan De , Anita Pal

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…

组合数学 · 数学 2017-08-29 Abdul Rauf Nizami , Muhammad Idrees , Numan Amin

Szeged, PI and Mostar indices are some of the most investigated distance-based molecular descriptors. Recently, many different variations of these topological indices appeared in the literature and sometimes they are all together called…

组合数学 · 数学 2021-02-15 Simon Brezovnik , Niko Tratnik

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.…

综合数学 · 数学 2024-06-26 Z. Aliannejadi , S. Shafiee Alamoti

In the last forty years, many scientists used graph theory to develop mathematical models for analyzing structures and properties of various chemical compounds. In this paper, we will establish formulas and bounds for generalized first…

组合数学 · 数学 2024-09-11 Sanju Vaidya , Jeff Chang

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…

概率论 · 数学 2021-02-26 Panpan Zhang , Xiaojing Wang

Let G be a simple connected molecular graph with vertex set $V(G)$ and edge set $E(G)$. One important modification of classical Zagreb index, called hyper Zagreb index $HM(G)$ is defined as the sum of squares of the degree sum of the…

离散数学 · 计算机科学 2017-03-27 Nilanjan De

Augmented Zagreb Index is a newly defined degree based topological invariant which has been well established for its better correlation properties and is defined as $AZI(G)= \sum_{uv\in E(G)}(\frac{d_G (u)d_G (v)}{d_G (u)+ d_G (v)-2})^3 $,…

组合数学 · 数学 2016-06-02 Nazeran Idrees , Afshan Sadiq , Muhammad Jawwad Saif , Asia Rauf

The first multiplicative Zagreb index of a graph $G$ is the product of the square of every vertex degree, while the second multiplicative Zagreb index is the product of the products of degrees of pairs of adjacent vertices. In this paper,…

组合数学 · 数学 2017-04-21 Shaohui Wang , Chunxiang Wang , Lin Chen , Jia-Bao Liu

In this paper, we investigate the edge-Wiener index, the Szeged index, the edge-Szeged index, and the PI index, which are some of the most studied distance-based topological indices. As the main result we show that for benzenoid systems…

组合数学 · 数学 2018-08-28 Matevž Črepnjak , Niko Tratnik

In this paper, we characterize the structure and topological indices of a class of random spider trees (RSTs) such as degree-based Gini index, degree-based Hoover index, generalized Zagreb index and other indices associated with these. We…

概率论 · 数学 2022-04-25 Saylé C. Sigarreta , Saylí M. Sigarreta , Hugo Cruz-Suárez

The authors Mili$\breve{c}$evi$\acute{c}$ et al. introduced the reformulated Zagreb indices, which is a generalization of classical Zagreb indices of chemical graph theory. In the paper, we characterize the extremal properties of the first…

组合数学 · 数学 2014-06-30 Shengjin Ji , Xia Li , Yongke Qu

For a graph $G$, the first multiplicative Zagreb index $\prod_1$ is equal to the product of squares of the vertex degrees, and the second multiplicative Zagreb index $\prod_2$ is equal to the product of the products of degrees of pairs of…

组合数学 · 数学 2016-11-21 Shaohui Wang , Chunxiang Wang , Jia-Bao Liu

To avoid extensive lab work on properties of chemical compounds, QSPR/QSAR analysis for topological descriptors is a productive statistical approach to analyze various physicochemical properties of chemical compounds. Many researchers have…

化学物理 · 物理学 2023-05-23 A. Bharali , Mohammad Essa Nazari , Amanullah Nabavi
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