New Results on Second Inverse Sum Indeg Index

Document Type : Research Paper

Authors

1 Faculty of science‎, ‎Mahallat Institute of Higher Education‎, ‎Mahallat‎, ‎Iran

2 Faculty of Science‎, ‎University of Kragujevac‎, ‎Kragujevac‎, ‎Serbia

3 Bishop Chulaparambil Memorial College‎, ‎Kottayam-686001‎, ‎India

10.22052/ijmc.2025.257454.2055

Abstract

‎The second inverse sum indeg topological index $(ISI_2)$ is considered as a valuable tool for the study of graphs and trees‎. This index is systematically investigated‎ for the first time‎, ‎and its upper and lower bounds are derived for general graphs and trees‎. ‎Furthermore‎, ‎comparisons between $ISI_2$ and other existing topological indices are presented‎. The results demonstrate that $ISI_2$ not only provides valuable insights into‎ the structure of graphs but also serves as a powerful instrument for modeling and‎ ‎analyzing complex networks‎, ‎particularly in chemistry and pharmacology‎. Specifically‎, ‎$ISI_2$ exhibits significant potential in predicting physicochemical‎ properties of molecules‎, ‎such as polarity‎, ‎boiling point‎, ‎and biological activity‎. ‎Thus‎, $ISI_2$ may serve for the design and optimization of novel drug molecules and chemical compounds‎.

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Main Subjects


[1] I. Gutman and O. E. Polansky, Mathematical Concepts in Organic Chemistry, Springer, Berlin, 1986.
[2] A. Ali, L. Zhong and I. Gutman, Harmonic index and its generalizations: extremal results and bounds, MATCH Commun. Math. Comput. Chem. 81 (2019) 249–311.
[3] K. C. Das, On comparing Zagreb indices of graphs, MATCH Commun. Math. Comput. Chem. 63 (2010) 433–440.
[4] M. Sohrabi-Haghighat and M. Rostami, Using linear programming to find the extremal graphs with minimum degree 1 with respect to geometric-arithmetic index, Appl. Math. Eng. Manag. Tech. 3 (2015) 534–539.
[5] M. Sohrabi-Haghighat and M. Rostami, The minimum value of geometric-arithmetic index of graphs with minimum degree 2, J. Comb. Optim. 34 (2017) 218–232.
[6] S. Wagner and H. Wang, Introduction to Chemical Graph Theory, CRC Press, Boca Raton, 2018.
[7] P. V. Khadikar, On a novel structural descriptor PI, Natl. Acad. Sci. Lett. 23 (2000) 113–118.
[8] P. E. John, P. V. Khadikar and J. Singh, A method for computing the PI index of benzenoid hydrocarbons using orthogonal cuts, J. Math. Chem. 42 (2007) 37–45, https://doi.org/10.1007/s10910-006-9100-2.
[9] P. V. Khadikar, P. P. Kale, N. V. Deshpande, S. Karmarkar and V. K. Agrawal, Novel PI indices of hexagonal chains, J. Math. Chem. 29 (2001) 143–150, https://doi.org/10.1023/A:1010931213729.
[10] P. V. Khadikar, S. Karmarkar and V. K. Agrawal, A novel PI index and its applications to QSPR/QSAR studies, J. Chem. Inf. Comput. Sci. 41 (2001) 934–949, https://doi.org/10.1021/ci0003092.
[11] P. V. Khadikar, N. V. Deshpande, P. P. Kale, A. Dobrynin, I. Gutman and G. Domotor, The Szeged index and an analogy with the Wiener index, J. Chem. Inf. Comput. Sci. 35 (1995) 547–550, https://doi.org/10.1021/ci00025a024.
[12] I. Gutman, P. V. Khadikar, P. V. Rajput and S. Karmarkar, The Szeged index of polyacenes, J. Serb. Chem. Soc. 60 (1995) 759–764.
[13] G. Fath–Tabar, B. Furtula and I. Gutman, A new geometric-arithmetic index, J. Math. Chem. 47 (2010) 477–486, https://doi.org/10.1007/s10910-009-9584-7.
[14] K. C. Das, I. Gutman and B. Furtula, On second geometric-arithmetic index of graphs, Iranian J. Math. Chem. 1 (2010) 17–28, https://doi.org/10.22052/IJMC.2010.5151.
[15] Z. Tang and Y. Hou, Note on the second geometric–arithmetic index, MATCH Commun. Math. Comput. Chem. 65 (2011) 705–712.
[16] N. Dehgardi, H. Aram and A. Khodkar, The second geometric-arithmetic index for trees and unicyclic graphs, Iranian J. Math. Chem. 9 (2018) 279–287, https://doi.org/10.22052/IJMC.2017.81079.1277.
[17] A. Graovac and M. Ghorbani, A new version of atom–bond connectivity index, Acta Chim. Slov. 57 (2010) 609–612.
[18] M. Rostami and M. Sohrabi-Haghighat, Further results on new version of atom-bond connectivity index, MATCH Commun. Math. Comput. Chem. 71 (2014) 21–32.
[19] M. Rostami, M. Sohrabi-Haghighat and M. Gorbani, On second atom-bond connectivity index, Iranian J. Math. Chem. 4 (2013) 265–270, https://doi.org/10.22052/IJMC.2013.5302.
[20] M. Sohrabi-Haghighat and M. Rostami, Relations between second geometric-arithmetic index and second atom-bond connectivity index, Int. J. Appl. Math. Stat. 57 (2018) 73–81.
[21] R. Alidehi-Ravandi and H. Omer Abdullah, Topological indices of drug molecular structures: An application with the treatment and prevention of COVID-19, J. Disc. Math. Appl. 8 (2023) 81–101, https://doi.org/10.22061/JDMA.2023.1944.
[22] I. Gutman, M. Togan, A. Yurttas, A. S. Cevik and I. N. Cangul, Inverse problem for sigma index, MATCH Commun. Math. Comput. Chem. 79 (2018) 491–508.