Topological indices are numbers that applied to a graph and can be used describe specific properties through algebraic structures. Algebraic theory is helpful tool in range of chemistry domains. Because it helps explain how the different symmetries molecules crystals affect their structure dynamics, powerful theoretical approach for forecasting both common uncommon characteristics molecules. A ...

qspr study on benzene derivatives have been made using recently introduced topological methodology. in this study the relationship between the randic' (x'), balaban (j), szeged (sz),harary (h), wiener (w), hyperwiener and wiener polarity (wp) to the thermal energy (eth), heat capacity (cv) and entropy (s) of benzene derivatives is represented.physicochemical properties are taken from the quantu...

In this work, novel atom-type-based topological indices, named AT indices, were presented as descriptors to encode structural information of a molecule at the atomic level. The descriptors were successfully used for simultaneous quantitative structure-retention relationship (QSRR) modeling of saturated alcohols on different stationary phases (SE-30, OV-3, OV-7, OV-11, OV-17 and OV-25). At first...

For a nontrivial graph G, its first Zagreb coindex is defined as the sum of degree sum over all non-adjacent vertex pairs in G and the second Zagreb coindex is defined as the sum of degree product over all non-adjacent vertex pairs in G. Till now, established results concerning Zagreb coindices are mainly related to composite graphs and extremal values of some special graphs. The existing liter...

In graph theory, lattices are used when some structural part of the repeats itself finitely or infinitely many times. They have applications in complex analysis and geometry mathematics, also natural chemical theory. As a lattice can be taken as graph, it is possible to use them study large networks. Recently, topological indices pentagonal chains studied here, we double similarly that work. We...