DFT-based QSAR study of valproic acid and its derivatives

QSAR and Combinatorial Science

Volumn 27, Issue 4, 2008, Pages 469-474

  Hashemianzadeh, Majid ^a   Safarpour, Mohammad Ali ^a   Gholamjani Moghaddam, Kiana ^a   Mehdipour, Ahmad Reza ^b  

^a IRAN UNIVERSITY OF SCIENCE AND TECHNOLOGY   (Iran)

^b SHIRAZ UNIVERSITY OF MEDICAL SCIENCES   (Iran)

Author keywords

DFT; Genetic algorithm; QSAR; Valproic acid

Indexed keywords

BIOACTIVITY; COMPUTATIONAL CHEMISTRY; GENETIC ALGORITHMS; MOLECULAR GRAPHICS; QUANTUM CHEMISTRY;

DFT; DFT THEORY; DFT-BASED; MOLECULAR DESCRIPTORS; MULTIPLE LINEAR REGRESSIONS; QSAR; QSAR STUDIES; QUANTUM CHEMICAL DESCRIPTORS; STEPWISE METHODS; VALPROIC ACID;

MULTIPLE LINEAR REGRESSION;

VALPROIC ACID; VALPROIC ACID DERIVATIVE;

ACCURACY; ANTICONVULSANT ACTIVITY; ARTICLE; CONTROLLED STUDY; DENSITY FUNCTIONAL THEORY; GENETIC ALGORITHM; MOLECULAR INTERACTION; MOUSE; MULTIPLE LINEAR REGRESSION ANALYSIS; NONHUMAN; PRIORITY JOURNAL; QUANTITATIVE STRUCTURE ACTIVITY RELATION; QUANTUM CHEMISTRY;

EID: 54949129801     PISSN: 1611020X     EISSN: 16110218     Source Type: Journal    
DOI: 10.1002/qsar.200710093     Document Type: Article

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