Quantum Chemical-QSAR Study of Some Newly Synthesized 1,4-Dihydropyridine Calcium Channel Blockers

QSAR and Combinatorial Science

Volumn 22, Issue 9-10, 2004, Pages 997-1005

  Safarpour, M A ^a   Hemmateenejad, B ^b   Miri, R ^b   Jamali, M ^a  

^a PERSIAN GULF UNIVERSITY   (Iran)

^b SHIRAZ UNIVERSITY OF MEDICAL SCIENCES   (Iran)

Author keywords

Ab initio; Calcium Channel; Dihydropyridine; Genetic Algorithm; Neural Network; QSAR

Indexed keywords

BIOACTIVITY; CALCIUM; CHEMICAL BONDS; COMPUTATIONAL CHEMISTRY; ELECTRONEGATIVITY; GENETIC ALGORITHMS; LINEAR REGRESSION; MEAN SQUARE ERROR; MOLECULES; NEURAL NETWORKS; QUANTUM CHEMISTRY;

AB INITIO; CALCIUM CHANNEL BLOCKERS; CALCIUM CHANNELS; DIHYDROPYRIDINES; NEURAL-NETWORKS; QSAR; QSAR MODEL; QSAR STUDIES; QUANTUM CHEMICAL; SYNTHESISED;

FORECASTING;

4 (1 METHYL 5 NITRO 2 IMIDAZOLYL)DIHYDROPYRIDINE; CALCIUM CHANNEL BLOCKING AGENT; NITROIMIDAZOLE DERIVATIVE; NITROIMIDAZOLYL 1,4 DIHYDROPYRIDINE; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; ANALYTICAL ERROR; ARTICLE; ARTIFICIAL NEURAL NETWORK; CORRELATION COEFFICIENT; DRUG ACTIVITY; DRUG STRUCTURE; ELECTRIC POTENTIAL; ELECTRON; ENERGY; GENETIC ALGORITHM; GUINEA PIG; HARDNESS; ILEUM; LINEAR REGRESSION ANALYSIS; MODEL; NONHUMAN; NONLINEAR SYSTEM; NORMAL DISTRIBUTION; PHYSICAL CHEMISTRY; PREDICTION; PRIORITY JOURNAL; QUANTITATIVE STRUCTURE ACTIVITY RELATION; QUANTUM CHEMISTRY; STRUCTURE ANALYSIS;

CAVIA PORCELLUS; SUS SCROFA;

EID: 1042300012     PISSN: 1611020X     EISSN: None     Source Type: Journal    
DOI: 10.1002/qsar.200330852     Document Type: Article

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