Determination of critical properties of alkanes derivatives using multiple linear regression

DOI10.22052/IJMC.2017.58461.1225MaRDI QIDQ4617705zbMATH OpenOpenAlexFDO

Authors Esmat Mohammadinasab

Publication date 7 February 2019

Full work available at URL https://ijmc.kashanu.ac.ir/article_44911_1b000378a12cd94d31436a61444db1f5.pdf

zbMATH Keywords

alkanesQSPRcritical propertiesMLR

Mathematics Subject Classification ID

Applications of graph theory (05C90) Classical and relativistic thermodynamics (80A10) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

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Cites work

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• Bounds on Harary index
• Introduction to linear regression analysis.
• On general Randić indices
• On history of the Randić index and emerging hostility toward chemical graph theory
• QSPR modeling of heat capacity, thermal energy and entropy of aliphatic aldehydes by using topological indices and MLR method
• QSPR study on benzene derivatives to some physico-chemical properties by using topological indices

Cited in

(7)

• Quantitative structure property relations (QSPRs) for predicting standard absolute entropy, \(S^0_{298}\), of inorganic compounds
• scientific article; zbMATH DE number 9988 (Why is no real title available?)
• Structure-property based model for alkanes boiling points
• scientific article; zbMATH DE number 6177902 (Why is no real title available?)
• Prediction of \(\Delta H^0_{f(\mathrm{gas})}\) ,\(\Delta H^0_{f(\mathrm{liq})}\) of amines derivatives using chemometrics (a quantitative structure-property relationship study)
• Modelling normal boiling points of alkanes by linear regression using the SD index
• scientific article; zbMATH DE number 2021867 (Why is no real title available?)

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