Combinatorial screening of polymer precursors for preparation of benzo[α] pyrene imprinted polymer: An ab initio computational approach

Journal of Molecular Modeling

Volumn 18, Issue 5, 2012, Pages 1969-1981

  Khan, Muntazir S ^a   Wate, Prateek S ^b   Krupadam, Reddithota J ^a  

^a NATIONAL ENVIRONMENTAL ENGINEERING RESEARCH INSTITUTE   (India)

^b University of Florida   (United States)

Author keywords

Combinatorial screening; Computer simulation; Molecular recognition; Molecularly imprinted polymer; Polymer precursors

Indexed keywords

BENZO[A]PYRENE; ETHYLENE GLYCOL DIMETHACRYLATE; METHACRYLIC ACID; MOLECULARLY IMPRINTED POLYMER; MONOMER; POLYMER; RECEPTOR;

AB INITIO CALCULATION; ADSORPTION; ARTICLE; BINDING AFFINITY; BINDING SITE; COMBINATORIAL CHEMISTRY; CONCEPTUAL FRAMEWORK; CONFORMATION; CROSS LINKING; ENERGY TRANSFER; MOLECULAR IMPRINTING; MOLECULAR INTERACTION; MOLECULAR RECOGNITION; POLYMERIZATION; PRIORITY JOURNAL; QUANTUM MECHANICS; ULTRAVIOLET RADIATION; VALIDITY;

ADSORPTION; AIR POLLUTANTS, OCCUPATIONAL; BENZO(A)PYRENE; BINDING SITES; COMBINATORIAL CHEMISTRY TECHNIQUES; COMPUTER SIMULATION; KINETICS; LIBRARIES, DIGITAL; METHACRYLATES; MODELS, CHEMICAL; MOLECULAR IMPRINTING; POLYMERS; REPRODUCIBILITY OF RESULTS; THERMODYNAMICS; ULTRAVIOLET RAYS;

EID: 84861227452     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-011-1218-x     Document Type: Article

References (31)

1. Haupt K, Mosbach K (2000) Chem Rev 100:2495-2504
2. Henry OYF, Cullen DC, Piletsky SA (2005) Anal Bioanal Chem 382:947-956
3. Sellergren B (2001) Molecularly imprinted polymers: man-made mimics of antibodies and their applications in analytical chemistry. Elsevier, Amsterdam
4. Wulff G, Sarhan A, Zabrocki K (1973) Tetrahedron Lett 4329-4332
5. Wulff G, Vesper W, Grobe-Einsler W, Sarhan A (1977) Macromol Chem 178:2799-2816
6. Wulff G, Poll HG (1987) Macromol Chem 188:741-748
7. Vlatakis G, Andersson LI, Muller R, Mosbach K (1993) Nature 361:645-647
8. Yu C, Mosbach K (2000) J Chromatogr A 888:63-72
9. Chen WY, Chen CS, Lin FY (2001) J Chromatogr A 923:1-6
10. Kirsch N, Alexander C, Lubke M, Whitcombe MJ, Vulfson EN (2000) Polymer 41:5583-5590
11. Andersson HS, Koch-Schmidt AC, Ohlson S, Mosbach K (1996) J Mol Recognit 9:675-682
12. Katz A, Davis ME (1999) Macromolecules 32:4113-4121
13. Andersson HS, Karlesson JG, Piletsky SA, KouchSchmidt AC, Mosbach K, Nicholls IA (1999) J Chromatogr A 848: 39-49
14. Nicholls IA (1995) Chem Lett 11:1035-1036
15. Krupadam RJ, Khan MS, Wate SR (2010) Water Res 44:681-688
16. McNiven S, Yokobayashi Y, Cheong SH, Karube I (1997) Chem Lett 12:1297-1298
17. Lanza F, Sellergren B (1999) Anal Chem 71:2092-2096
18. Takeuchi T, Fukuma D, Matsui J (1999) Anal Chem 71:285-290
19. Subrahmanyam S, Piletsky SA, Piletska EV, Chen B, Karim K, Turner APF (2001) Biosens Bioelectron 16:631-637
20. Wu L, Sun B, Li Y, Chang W (2003) Analyst 128:944-949
21. Meng Z, Yamazaki T, Sode K (2004) Biosens Bioelectron 20:1068-1075
22. Takeuchi T, Dobashi A, Kimura K (2000) Anal Chem 72:2418-2422
23. Piletsky S, Karim K, Piletska EV, Day CJ, Freebairn KW, Legge C, Turner APF (2001) Analyst 126:1826-1830
24. Chianella I, Lotierzo M, Piletksy SA, Tothill IE, Chen BN, Karim K, Turner APF (2002) Anal Chem 74:1288-1293
25. Chianella I, Karim K, Piletska EV, Preston C, Piletsky SA (2006) Anal Chim Acta 559:73-78
26. Dumitru P, Jolanta L (2005) Polymer 46:7543-7556
27. Dong WG, Yan M, Zhang ML, Liu Z, Li YM (2005) Anal Chim Acta 542:186-193
28. HyperChem® for Windows. Hypercube. HyperChem Release version 8.0. http://www.hyper.com/
29. Baggiani C, Giraudi G, Giovannoli C, Tozzi C, Anfossi L (2004) Anal Chim Acta 504:43-52
30. Bhagat B, Krupadam RJ (2010) Adsorpt Sci Technol 28:79-88
31. Whitcombe MJ, Martin L, Vulfson EN (1998) Chromatographia 47:457-464