Computer simulation of volatile organic compound adsorption in atomistic models of molecularly imprinted polymers

Langmuir

Volumn 25, Issue 9, 2009, Pages 5352-5359

  Herdes, Carmelo ^a   Sarkisov, Lev ^a  

^a UNIVERSITY OF EDINBURGH   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMISTIC MODELS; COMPUTATIONAL DESIGN; DESIGN STRATEGIES; DETAILED MODELS; LENGTH SCALE; MOLECULAR LEVELS; MOLECULAR MODELS; MOLECULARLY IMPRINTED POLYMER; OPTIMIZATION PARAMETER; OTHER APPLICATIONS; PROCESSING CONDITION; SENSING TECHNOLOGY; SINGLE BINDING SITES;

ADSORPTION; BENZENE; BINDING ENERGY; BINDING SITES; MICROSTRUCTURE; MOLECULAR BIOLOGY; MOLECULAR GRAPHICS; MOLECULAR MODELING; MOLECULAR RECOGNITION; ORGANIC POLYMERS; SIMULATORS; TOLUENE; VOLATILE ORGANIC COMPOUNDS;

PLASMA WAVES;

EID: 66549109215     PISSN: 07437463     EISSN: None     Source Type: Journal    
DOI: 10.1021/la804168b     Document Type: Article

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