Prediction of aromatic amines mutagenicity from theoretical molecular descriptors

SAR and QSAR in Environmental Research

Volumn 14, Issue 4, 2003, Pages 237-250

  Gramatica, P ^a   Consonni, V ^b   Pavan, M ^b  

^a UNIVERSITY OF INSUBRIA   (Italy)

^b UNIVERSITY OF MILANO BICOCCA   (Italy)

Author keywords

Aromatic amines; Molecular descriptors; Mutagenicity; QSAR; Regression models; Training set selection

Indexed keywords

AROMATIC COMPOUNDS; AROMATIZATION; COMPUTATIONAL CHEMISTRY; GENETIC ALGORITHMS; MOLECULAR GRAPHICS; REGRESSION ANALYSIS; STATISTICAL TESTS;

AMES TEST; AROMATIC AMINES; DATA SET; HETEROAROMATICS; MOLECULAR DESCRIPTORS; MULTIVARIATE REGRESSION; MUTAGENICITY; QUANTITATIVE STRUCTURE ACTIVITY RELATIONSHIP; REGRESSION MODELLING; TRAINING SET SELECTION;

AMINES;

AMINE; MUTAGENIC AGENT;

ALGORITHM; ARTICLE; CHEMISTRY; GENETICS; MUTAGEN TESTING; PREDICTION AND FORECASTING; QUANTITATIVE STRUCTURE ACTIVITY RELATION; SALMONELLA TYPHIMURIUM; STATISTICAL MODEL;

ALGORITHMS; AMINES; LINEAR MODELS; MUTAGENICITY TESTS; MUTAGENS; PREDICTIVE VALUE OF TESTS; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; SALMONELLA TYPHIMURIUM;

EID: 0141462455     PISSN: 1062936X     EISSN: None     Source Type: Journal    
DOI: 10.1080/1062936032000101484     Document Type: Article

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