QSPR ANALYSIS OF CERTAIN ANTI-HIV DRUGS

Ishita Sarkar; Manjunath Nanjappa

doi:10.56827/10.56827/SEAJMMS.2022.1803.24

Ishita Sarkar Department of Mathematics, CHRIST (Deemed to be University), Bengaluru - 560029, Karnataka, INDIA
Manjunath Nanjappa School of Engineering and Technology, CHRIST (Deemed to be University), Bengaluru - 560074, Karnataka, INDIA

DOI: https://doi.org/10.56827/10.56827/SEAJMMS.2022.1803.24

Abstract

A broad spectrum of advanced medications appears yearly following the accelerated evolution of the chemical and pharmaceutical industry. In this paper, various degree-based and neighborhood degree sum-based topological indices of some anti-HIV drugs are explored applying the M-polynomial and NM-polynomial formulations. Moreover, QSPR analysis is carried out for the topological indices with regard to the physico-chemical properties of the anti-HIV drugs. The activity of nucleoside and non-nucleoside reverse transcriptase inhibitors is implemented as in drug configuration to manifest the significance of topological indices in the medicinal world. The procured outcomes affirm that topological indices being stud- ied reflect effective correlation in accordance to physical and chemical properties of the anti-HIV drugs and consequently can assist in development of advanced and promising pharmaceutical for HIV medication.

Author Biographies

Ishita Sarkar, Department of Mathematics, CHRIST (Deemed to be University), Bengaluru - 560029, Karnataka, INDIA

Manjunath Nanjappa, School of Engineering and Technology, CHRIST (Deemed to be University), Bengaluru - 560074, Karnataka, INDIA