We were motivated to examine the quantitative structure–property relationships (QSPR) of
nonsteroidal anti-inflammatory drugs (NSAIDs) by prior work on medicines. To do this, we …

A topological index, which is a number, is connected to a graph. It is often used in
chemometrics, biomedicine, and bioinformatics to anticipate various physicochemical …

The threat of developing a cancer therapy has been there for the past two to three decades.
Almost 10 million people worldwide are affected by this illness each year. Anticancer …

Topological indices are invariant numerical quantities of a graph that give facts about the
structure of graphs and are found to be very helpful in predicting the physical properties of …

In this paper, we dealt with two very well-known eigenvalue-based molecular descriptors
such as the energy of graph (E (G)) and Estrada index (EE (G)). We test their predictive …

Porphyrazine and tetrakis porphyrazine are organic compounds with intricate ring structures.
They are made up of four indole rings that fuse together to form a larger cyclic structure …

The atom-bond-connectivity (ABC) index is one of the well-investigated degree-based
topological indices. The atom-bond sum-connectivity (ABS) index is a modified version of …

Macromolecules are gaining much attention in various fields today. Dendrimers are
artificially synthesized macromolecules by convergent or divergent approach. They are …

Topological descriptors have drawn more interest recently because of the simplicity of
generation and quick evaluation times, by avoiding time-consuming laboratory experiments …

This work uses rational curve fitting models to investigate the complex link between
topological indices and entropy metrics in calcium hydroxide (C a (OH) 2) networks. Entropy …