Structure-property modeling for thermodynamic properties of benzenoid hydrocarbons by temperature-based topological indices

Structure-property modeling for thermodynamic properties of benzenoid hydrocarbons by temperature-based topological indices

Quantitative structure-property relationship (QSPR) modeling employs contemporary mathematical tools to predict physicochemical, thermodynamic and biological properties of compounds from their chemical structures. Graphical indices provide those mathematical tools and efficiently correlate physicoch...

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Bibliographic Details
Main Authors: Sakander Hayat, Asad Khan, Khadija Ali, Jia-Bao Liu
Format: Article
Language:English
Published: Elsevier 2024-03-01
Series:Ain Shams Engineering Journal
Subjects:
Temperature index
Heat capacity
Entropy
Benzenoid hydrocarbons
Structure-property modeling
Online Access:http://www.sciencedirect.com/science/article/pii/S2090447923004756

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http://www.sciencedirect.com/science/article/pii/S2090447923004756

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