A computational approach to studying monomer selectivity towards the template in an imprinted polymer

Journal of Molecular Modeling

Volumn 15, Issue 7, 2009, Pages 829-836

  Riahi, Siavash ^a   Edris Tabrizi, Farrin ^b   Javanbakht, Mehran ^b   Ganjali, Mohammad Reza ^a   Norouzi, Parviz ^a  

^a UNIVERSITY OF TEHRAN   (Iran)

^b AMIRKABIR UNIVERSITY OF TECHNOLOGY   (Iran)

Author keywords

Chlorphenamine; Computational chemistry; Density functional theory; Molecularly imprinted polymer; Monomer template interactions

Indexed keywords

CHLORPHENIRAMINE; DIPHENHYDRAMINE; METHACRYLIC ACID; MONOMER; POLYMER; SOLVENT;

ARTICLE; CHEMICAL STRUCTURE; COMPUTER SIMULATION; DENSITY FUNCTIONAL THEORY; DIPOLE; HYDROGEN BOND; INFRARED SPECTROSCOPY; MATHEMATICAL ANALYSIS; MOLECULAR IMPRINTING; POLARIZATION; PRIORITY JOURNAL; STRUCTURE ANALYSIS; VALIDATION PROCESS;

CHLORPHENIRAMINE; COMPUTER SIMULATION; DIPHENHYDRAMINE; METHACRYLATES; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR IMPRINTING; MOLECULAR STRUCTURE; POLYMERS;

EID: 67349134169     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-008-0437-2     Document Type: Article

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