Highly Correlated Wiener polarity Index: A Model to Predict Log p

Immadesetty Pothu Raju

Abstract


Wiener polarity index of a more generalized graph of chemical graphs of polyacenes and phenylenes is computed and the results are used to design a model for predicting log p values of polyacenes. The multiple regression with two descriptors gives improved models with correlation coefficient 0.999999980642502.

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DOI: http://doi.org/10.11591/ijaas.v3.i1.pp19-24

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International Journal of Advances in Applied Sciences (IJAAS)
p-ISSN 2252-8814, e-ISSN 2722-2594
This journal is published by the Institute of Advanced Engineering and Science (IAES) in collaboration with Intelektual Pustaka Media Utama (IPMU).

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