Computation of Vertex-Based Topological Descriptors of Organometallic Monolayers of TM3C12S12

Dalal Alrowaili, Faraha Ashraf, Rifaqat Ali, Arsalan Shoukat, Aqila Shaheen, Mehran Azeem (malikmehran266@gmail.com), Imran Siddique and Gohar Ali

Journal of Mathematics, 2021, vol. 2021, 1-7

Abstract: Topological descriptors are mathematical values related to chemical structures which are associated with different physicochemical properties. The use of topological descriptors has a great contribution in the field of quantitative structure-property relationship (QSPR) and quantitative structure-activity relationship (QSAR) modeling. These are mathematical relationships between different molecular properties or biological activity and some other physicochemical or structural properties. In this article, we calculate few vertex degree-based topological indices/descriptors of the organometallic monolayer structure. At present, the numerical programming of the biological structure with topological descriptors is increasing in consequence in invigorating science, bioinformatics, and pharmaceutics.

Date: 2021
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Persistent link: https://EconPapers.repec.org/RePEc:hin:jjmath:8572049

DOI: 10.1155/2021/8572049

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