Quantitative structure-activity relationships (QSAR) with the molnet molecular graph machine

Current Bioinformatics

Volumn 6, Issue 2, 2011, Pages 261-268

  Ivanciuc, Ovidiu ^a  

^a University of Texas Medical Branch School of Medicine   (United States)

Author keywords

Artificial neural network; Glycogen synthase kinase 3 ; Graph mining; Gsk 3 ; MGM; Molecular graph machines; QSAR; Quantitative structure activity relationships; Topological indices

Indexed keywords

COMPUTATIONAL CHEMISTRY; ENCODING (SYMBOLS); ENZYMES; MOLECULAR GRAPHICS; MOLECULES; NEURAL NETWORKS; TOPOLOGY;

GLYCOGEN SYNTHASE KINASE; GLYCOGEN SYNTHASE KINASE-3Β; GRAPH MACHINE; GRAPH MINING; GSK-3Β; MOLECULAR GRAPH MACHINE; MOLECULAR GRAPHS; QUANTITATIVE STRUCTURE ACTIVITY RELATIONSHIP; TOPOLOGICAL INDEX;

ATOMS;

GLYCOGEN SYNTHASE KINASE 3BETA; HYDROGEN;

ARTIFICIAL NEURAL NETWORK; CHEMICAL STRUCTURE; LEARNING; MOLECULE; PERCEPTRON; PREDICTION; PRIORITY JOURNAL; PROTEIN LOCALIZATION; QUANTITATIVE STRUCTURE ACTIVITY RELATION; REVIEW;

EID: 79958223686     PISSN: 15748936     EISSN: 15748936     Source Type: Journal    
DOI: 10.2174/1574893611106020261     Document Type: Review

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