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Derivation of mathematical closed form expressions for certain irregular topological indices of 2D nanotubes

A numeric quantity that characterizes the whole structure of a network is called a topological index. In the studies of QSAR and QSPR, the topological indices are utilized to predict the physical features related to the bioactivities and chemical reactivity in certain networks. Materials for 2D nano...

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Autores principales: Ullah, Asad, Zaman, Shahid, Hussain, Arshad, Jabeen, Asma, Belay, Melaku Berhe
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10336147/
https://www.ncbi.nlm.nih.gov/pubmed/37433876
http://dx.doi.org/10.1038/s41598-023-38386-1
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author Ullah, Asad
Zaman, Shahid
Hussain, Arshad
Jabeen, Asma
Belay, Melaku Berhe
author_facet Ullah, Asad
Zaman, Shahid
Hussain, Arshad
Jabeen, Asma
Belay, Melaku Berhe
author_sort Ullah, Asad
collection PubMed
description A numeric quantity that characterizes the whole structure of a network is called a topological index. In the studies of QSAR and QSPR, the topological indices are utilized to predict the physical features related to the bioactivities and chemical reactivity in certain networks. Materials for 2D nanotubes have extraordinary chemical, mechanical, and physical capabilities. They are extremely thin nanomaterials with excellent chemical functionality and anisotropy. Since, 2D materials have the largest surface area and are the thinnest of all known materials, they are ideal for all applications that call for intense surface interactions on a small scale. In this paper, we derived closed formulae for some important neighborhood based irregular topological indices of the 2D nanotubes. Based on the obtained numerical values, a comparative analysis of these computed indices is also performed.
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spelling pubmed-103361472023-07-13 Derivation of mathematical closed form expressions for certain irregular topological indices of 2D nanotubes Ullah, Asad Zaman, Shahid Hussain, Arshad Jabeen, Asma Belay, Melaku Berhe Sci Rep Article A numeric quantity that characterizes the whole structure of a network is called a topological index. In the studies of QSAR and QSPR, the topological indices are utilized to predict the physical features related to the bioactivities and chemical reactivity in certain networks. Materials for 2D nanotubes have extraordinary chemical, mechanical, and physical capabilities. They are extremely thin nanomaterials with excellent chemical functionality and anisotropy. Since, 2D materials have the largest surface area and are the thinnest of all known materials, they are ideal for all applications that call for intense surface interactions on a small scale. In this paper, we derived closed formulae for some important neighborhood based irregular topological indices of the 2D nanotubes. Based on the obtained numerical values, a comparative analysis of these computed indices is also performed. Nature Publishing Group UK 2023-07-11 /pmc/articles/PMC10336147/ /pubmed/37433876 http://dx.doi.org/10.1038/s41598-023-38386-1 Text en © The Author(s) 2023 https://creativecommons.org/licenses/by/4.0/Open Access This article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if changes were made. The images or other third party material in this article are included in the article's Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article's Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by/4.0/ (https://creativecommons.org/licenses/by/4.0/) .
spellingShingle Article
Ullah, Asad
Zaman, Shahid
Hussain, Arshad
Jabeen, Asma
Belay, Melaku Berhe
Derivation of mathematical closed form expressions for certain irregular topological indices of 2D nanotubes
title Derivation of mathematical closed form expressions for certain irregular topological indices of 2D nanotubes
title_full Derivation of mathematical closed form expressions for certain irregular topological indices of 2D nanotubes
title_fullStr Derivation of mathematical closed form expressions for certain irregular topological indices of 2D nanotubes
title_full_unstemmed Derivation of mathematical closed form expressions for certain irregular topological indices of 2D nanotubes
title_short Derivation of mathematical closed form expressions for certain irregular topological indices of 2D nanotubes
title_sort derivation of mathematical closed form expressions for certain irregular topological indices of 2d nanotubes
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10336147/
https://www.ncbi.nlm.nih.gov/pubmed/37433876
http://dx.doi.org/10.1038/s41598-023-38386-1
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