QSPR modeling of heats of combustion for carboxylic acids

QSAR and Combinatorial Science

Volumn 26, Issue 5, 2007, Pages 647-652

  Duchowicz, Pablo R ^a   Garro, Juan C M ^b   Andrada, Matías F ^b   Castro, Eduardo A ^a   Fernández, Francisco M ^a  

^a INSTITUTO DE INVESTIGACIONES FISICOQUÍMICAS TEÓRICAS Y APLICADAS INIFTA   (Argentina)

^b UNIVERSIDAD NACIONAL DE SAN LUIS   (Argentina)

Author keywords

Carboxylic acid; Heat of combustion; Multivariable regression analysis; QSPR theory

Indexed keywords

COMBUSTION; REGRESSION ANALYSIS;

FORWARD STEPWISE REGRESSIONS; HEAT OF COMBUSTION; LINEAR REGRESSION ANALYSIS; MOLECULAR DESCRIPTORS; MULTIVARIABLE REGRESSION ANALYSIS; QSPR THEORY; QUALITY MODELING; REGRESSION TECHNIQUES; REPLACEMENT METHODS;

CARBOXYLIC ACIDS;

AROMATIC CARBOXYLIC ACID; CARBOXYLIC ACID DERIVATIVE; ESTER; FATTY ACID DERIVATIVE;

ARTICLE; CHEMICAL STRUCTURE; COMBUSTION; COMPUTER PROGRAM; HEATING; LINEAR REGRESSION ANALYSIS; MATHEMATICAL MODEL; PRIORITY JOURNAL; QUANTITATIVE STRUCTURE PROPERTY RELATION; TRANSESTERIFICATION;

EID: 34250664313     PISSN: 1611020X     EISSN: 16110218     Source Type: Journal    
DOI: 10.1002/qsar.200630073     Document Type: Article

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