Quantitative structure property relations (QSPRs) for predicting standard absolute entropy, S^0_298, of inorganic compounds

zbMATH Open1150.92011MaRDI QIDQ5450423FDOQ5450423

Authors: Lailong Mu, Changjun Feng 

Publication date: 20 March 2008

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zbMATH Keywords

multivariate linear regressionneural network methodstandard entropy

Mathematics Subject Classification ID

Linear regression; mixed models (62J05) Applications of statistics (62P99) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Cited In (6)

• Information content of molecular graph and prediction of gas phase thermal entropy of organic compounds
• QSPR modeling of heat capacity, thermal energy and entropy of aliphatic aldehydes by using topological indices and MLR method
• Predicting specific surface areas of layered double hydroxides based on support vector regression integrated with a residual bootstrapping method
• 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)
• QSPR study of phosphoric polyester glass transition temperatur by PLS
• CORAL: QSPRs of enthalpies of formation of organometallic compounds

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