From last two to three decades, the world is facing the threat of finding treatment for Cancer. This disease is striking almost ten million people every year throughout the world. Anticancer drugs are those which are used to cure malignant disease i.e. Cancer. These anticancer drugs are available in different forms including alkalyting agents, hormones and anti metabolites. Various examinations reveals that, there will be a adjacent relationship between the characteristics of alkanes and the anticancer drugs viz. Boiling point, melting point, enthalpy etc. with their chemical structures. In this proposed work, various topological indices are defined on some anticancer drugs to help the researchers to know the physical characteristics and chemical reaction associated with them. We also discuss the QSPR analysis of thirteen degree based topological indices. Further, we showcase that the characteristics have good correlation with physico-chemical characteristics of anticancer drugs.
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<p>The use of topological descriptors is the key method, regardless of great advances taking place in the field of drug design. Descriptors portray the chemical characteristic of a molecule in numerical form, that is used for QSAR/QSPR models. The numerical values related with chemical constitutions that correlates the chemical structure with the physical properties referto topological indices. The study of chemical structure with chemical reactivity or biological activity is termed as quantitative structure activity relationship, in which topological index play a significant role. Chemical graph theory is one such significant branches of science which play a key role in QSAR/QSPR/QSTR studies. This work is focused on computing various degree-based topological indices and regression model of nine anti-malaria drugs. Regression models are fitted for computed indices values with 6 physicochemical properties of the anti-malaria drugs are studied. Based on the results obtained, an analysis is carried out for various statistical parameters for which conclusions are drawn.</p>
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