Molecular topological invariants of certain chemical networks
Topological descriptors are the graph invariants that are used to explore the molecular topology of the molecular/chemical graphs. In QSAR/QSPR research, physico-chemical characteristics and topological invariants including Randić, atom-bond connectivity, and geometric arithmetic invariants are util...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
De Gruyter
2021-06-01
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| Series: | Main Group Metal Chemistry |
| Subjects: | |
| Online Access: | https://doi.org/10.1515/mgmc-2021-0010 |
| _version_ | 1818732575159484416 |
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| author | Ul Haq Bokhary Syed Ahtsham Imran Muhammad Akhter Shehnaz Manzoor Sadia |
| author_facet | Ul Haq Bokhary Syed Ahtsham Imran Muhammad Akhter Shehnaz Manzoor Sadia |
| author_sort | Ul Haq Bokhary Syed Ahtsham |
| collection | DOAJ |
| description | Topological descriptors are the graph invariants that are used to explore the molecular topology of the molecular/chemical graphs. In QSAR/QSPR research, physico-chemical characteristics and topological invariants including Randić, atom-bond connectivity, and geometric arithmetic invariants are utilized to corelate and estimate the structure relationship and bioactivity of certain chemical compounds. Graph theory and discrete mathematics have discovered an impressive utilization in the area of research. In this article, we investigate the valency-depended invariants for certain chemical networks like generalized Aztec diamonds and tetrahedral diamond lattice. Moreover, the exact values of invariants for these categories of chemical networks are derived. |
| first_indexed | 2024-12-17T23:35:45Z |
| format | Article |
| id | doaj.art-4fc670544b2f4776af80373f276948c1 |
| institution | Directory Open Access Journal |
| issn | 0792-1241 2191-0219 |
| language | English |
| last_indexed | 2024-12-17T23:35:45Z |
| publishDate | 2021-06-01 |
| publisher | De Gruyter |
| record_format | Article |
| series | Main Group Metal Chemistry |
| spelling | doaj.art-4fc670544b2f4776af80373f276948c12022-12-21T21:28:33ZengDe GruyterMain Group Metal Chemistry0792-12412191-02192021-06-0144114114910.1515/mgmc-2021-0010Molecular topological invariants of certain chemical networksUl Haq Bokhary Syed Ahtsham0Imran Muhammad1Akhter Shehnaz2Manzoor Sadia3Centre for Advanced Studies in Pure and Applied Mathematics, Bahauddin Zakariya University, Multan, PakistanDepartment of Mathematical Sciences, College of Science, United Arab Emirates University, P. O. Box 15551, Al Ain, United Arab EmiratesSchool of Natural Sciences, National University of Sciences and Technology, H-12, Islamabad, PakistanCentre for Advanced Studies in Pure and Applied Mathematics, Bahauddin Zakariya University, Multan, PakistanTopological descriptors are the graph invariants that are used to explore the molecular topology of the molecular/chemical graphs. In QSAR/QSPR research, physico-chemical characteristics and topological invariants including Randić, atom-bond connectivity, and geometric arithmetic invariants are utilized to corelate and estimate the structure relationship and bioactivity of certain chemical compounds. Graph theory and discrete mathematics have discovered an impressive utilization in the area of research. In this article, we investigate the valency-depended invariants for certain chemical networks like generalized Aztec diamonds and tetrahedral diamond lattice. Moreover, the exact values of invariants for these categories of chemical networks are derived.https://doi.org/10.1515/mgmc-2021-0010atom-bond connectivit indexgeometric-arithmetic indexgeneralized aztec diamondtetrahedral diamond lattice |
| spellingShingle | Ul Haq Bokhary Syed Ahtsham Imran Muhammad Akhter Shehnaz Manzoor Sadia Molecular topological invariants of certain chemical networks Main Group Metal Chemistry atom-bond connectivit index geometric-arithmetic index generalized aztec diamond tetrahedral diamond lattice |
| title | Molecular topological invariants of certain chemical networks |
| title_full | Molecular topological invariants of certain chemical networks |
| title_fullStr | Molecular topological invariants of certain chemical networks |
| title_full_unstemmed | Molecular topological invariants of certain chemical networks |
| title_short | Molecular topological invariants of certain chemical networks |
| title_sort | molecular topological invariants of certain chemical networks |
| topic | atom-bond connectivit index geometric-arithmetic index generalized aztec diamond tetrahedral diamond lattice |
| url | https://doi.org/10.1515/mgmc-2021-0010 |
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