Total and local (atom and atom type) molecular quadratic indices: Significance interpretation, comparison to other molecular descriptors, and QSPR/QSAR applications

Bioorganic and Medicinal Chemistry

Volumn 12, Issue 24, 2004, Pages 6351-6369

  Marrero Ponce, Yovani ^a  

^a Chem Bioactive Ctr Ctrl Univ L   (Cuba)

Author keywords

Factor analysis; QSAR QSAR studies; tomocomd cardd software; Total and local (atom and atom type) quadratic indices

Indexed keywords

2 VINYLFURAN DERIVATIVE; ALCOHOL DERIVATIVE; ETHYLENE DERIVATIVE; UNCLASSIFIED DRUG;

ANTIBACTERIAL ACTIVITY; ARTICLE; ATOM; CHEMICAL BOND; CHEMICAL STRUCTURE; DRUG DESIGN; INTERMETHOD COMPARISON; MATHEMATICAL ANALYSIS; MATHEMATICAL MODEL; MOLECULAR MODEL; PARTITION COEFFICIENT; QUANTITATIVE STRUCTURE ACTIVITY RELATION; STATISTICAL SIGNIFICANCE;

ALCOHOLS; ANTI-BACTERIAL AGENTS; ETHYLENES; MODELS, MOLECULAR; MODELS, THEORETICAL; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 8844273256     PISSN: 09680896     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmc.2004.09.034     Document Type: Article

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