Application of MOLMAP approach for QSAR modeling of various biological activities using substituent electronic descriptors

Journal of Computational Chemistry

Volumn 30, Issue 13, 2009, Pages 2001-2009

  Hemmateenejad, Bahram ^a,b   Mehdipour, Ahmad R ^b   Miri, Ramin ^b   Shamsipur, Mojtaba ^c  

^a SHIRAZ UNIVERSITY   (Iran)

^b SHIRAZ UNIVERSITY OF MEDICAL SCIENCES   (Iran)

^c RAZI UNIVERSITY   (Iran)

Author keywords

Kohonen network; MOLMAP; QSAR; Substituent electronic descriptors

Indexed keywords

3D ARRAYS; AGONIST ACTIVITY; ALCOHOL DEHYDROGENASE; BENZIMIDAZOLES; BIOLOGICAL ACTIVITIES; BIOLOGICAL DATA; COMPUTATION TIME; DATA ANALYSIS METHODS; DATA MATRICES; DEGREE OF ACCURACY; DESCRIPTORS; DISSOCIATION CONSTANT; IMIDAZOLINES; INFLUENZA VIRUS; INHIBITION ACTIVITY; KOHONEN; KOHONEN NETWORK; MATRIX; MOLECULAR MAPS; MOLMAP; NATRIURETIC; PARTIAL LEAST SQUARES; QSAR; QSAR MODEL; QSAR MODELING; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP STUDIES; QUANTUM CHEMICAL DESCRIPTORS; SUBSTITUENT ELECTRONIC DESCRIPTORS; THREE-DIMENSIONAL (3D) ARRAYS; THREE-WAY ANALYSIS;

AMIDES; BIOACTIVITY; DISSOCIATION; ELECTRONIC PROPERTIES; MOLECULAR GRAPHICS; MOLECULES; ORGANIC POLYMERS; SULFUR COMPOUNDS;

THREE DIMENSIONAL;

AMIDE; IMIDAZOLE DERIVATIVE; INDOLE DERIVATIVE;

ARTICLE; BIOLOGICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; QUANTITATIVE STRUCTURE ACTIVITY RELATION; QUANTUM THEORY;

AMIDES; IMIDAZOLES; INDOLES; MODELS, BIOLOGICAL; MOLECULAR STRUCTURE; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; QUANTUM THEORY;

EID: 69949157374     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.21198     Document Type: Article

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