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http://dx.doi.org/10.5012/bkcs.2013.34.8.2515

Molecular Docking and Molecular Dynamics Simulations of the Kinase Domain Inhibitor for an Epidermal Growth Factor Receptor  

Choi, Youngjin (BioChip Research Center & Inflammatory Disease Research Center, Hoseo University)
Kang, In-Cheol (BioChip Research Center & Inflammatory Disease Research Center, Hoseo University)
Cho, Eunae (Department of Bioscience and Biotechnology, Bio/Molecular Informatics Center & Center for Biotechnology Research in UBITA, Institute for Smart Biotechnology (ISB), Konkuk University)
Kim, Jaebum (Department of Animal Biotechnology, Center for Biotechnology Research in UBITA, Konkuk University)
Jeong, Karpjoo (Department of Advanced Technology Fusion, Center for Biotechnology Research in UBITA, Konkuk University)
Jung, Seunho (Department of Bioscience and Biotechnology, Bio/Molecular Informatics Center & Center for Biotechnology Research in UBITA, Institute for Smart Biotechnology (ISB), Konkuk University)
Publication Information
Bulletin of the Korean Chemical Society / v.34, no.8, 2013 , pp. 2515-2518 More about this Journal
Keywords
EGFR; Anti-cancer agent; CYP450; Molecular simulations; Drug discovery;
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1 Darden, T.; York, D.; Pedersen, L. J. Chem. Phys. 1993, 98, 10089.   DOI   ScienceOn
2 Feller, S. E.; Zhang, Y.; Pastor, R. W.; Brooks, B. R. J. Chem. Phys. 1995, 103, 4613.   DOI   ScienceOn
3 Jackman, D. M.; Miller, V. A.; Cioffredi, L. A.; Yeap, B. Y.; Jänne, P. A.; Riely, G. J.; Ruiz, M. G.; Giaccone, G.; Sequist, L. V.; Johnson, B. E. Clin. Cancer Res. 2009, 15, 5267.   DOI   ScienceOn
4 Pearson, M. K.; Fabbro, D. Expert Rev. Anticancer Ther. 2004, 4, 1113.   DOI   ScienceOn
5 Kim, E. Y.; Choi, Y.; Park, C. W.; Kang, I. C. Biochem. Biophys. Res. Comm. 2009, 389, 415.   DOI   ScienceOn
6 Alonso, H.; Bliznyuk, A. A.; Gready, J. E. Med. Res. Rev. 2006, 26, 531.   DOI   ScienceOn
7 Sakkiah, S.; Thangapandian, S.; Kim, Y.; Lee, K. W. Bull. Korean Chem. Soc. 2012, 33, 869.   DOI   ScienceOn
8 Gazit, A.; Yaish, P.; Gilon, C.; Levitzki, A. J. Med. Chem. 1989, 32, 2344.   DOI
9 Levitzki, A. FASEB J. 1992, 6, 3275.
10 Jo, M.; Thomas, K. S.; O'Donnell, D. M.; Gonias, S. L. J. Biol. Chem. 2003, 278, 1642.   DOI   ScienceOn
11 Morris, G. M.; Huey, R.; Lindstrom, W.; Sanner, M. F.; Belew, R. K.; Goodsell, D. S.; Olson, A. J. J. Comput. Chem. 2009, 30, 2785.   DOI   ScienceOn
12 Stamos, J.; Sliwkowski, M. X.; Eigenbrot, C. J. Biol. Chem. 2002, 277, 46265.   DOI   ScienceOn
13 Morris, G. M.; Goodsell, D. S.; Halliday, R. S.; Huey, R.; Hart, W. E.; Belew, R. K.; Olson, A. J. J. Comput. Chem. 1998, 19, 1639.   DOI   ScienceOn
14 Johnson, L. N.; Noble, M. E. M.; Owen, D. J. Cell 1996, 85, 149.   DOI   ScienceOn
15 Wood, E. R.; Truesdale, A. T.; McDonald, O. B.; Yuan, D.; Hassell, A. Cancer Res. 2004, 64, 6652.   DOI   ScienceOn
16 Li, J.; Ma, C.; Huang, Y.; Luo, J.; Huang, C. Oncogene 2003, 22, 211.   DOI   ScienceOn
17 Cosconati, S.; Forli, S.; Perryman, A. L.; Harris, R.; Goodsell, D. S.; Olson, A. J. Expert. Opin. Drug Discov. 2010, 5, 597.   DOI   ScienceOn
18 Brooks, B. R.; Bruccoleri, R. E.; Olafson, B. D.; States, D. J.; Swaminathan, S.; Karplus, M. J. Comput. Chem. 1983, 4, 187.   DOI
19 Jorgensen, W. L. J. Chem. Phys. 1983, 79, 926.   DOI
20 Ryckaert, J. P.; Ciccotti, G.; Berendsen, H. J. C. J. Comput. Phys. 1977, 23, 327.   DOI   ScienceOn
21 Mavromoustakos, T.; Durdagi, S.; Koukoulitsa, C.; Simcic, M.; Papadopoulos, M.G.; Hodoscek, M.; Grdadolnik, S. G. Curr. Med. Chem. 2011, 18, 2517.   DOI   ScienceOn
22 Kalyaanamoorthy, S.; Chen, Y. P. Drug Discov. Today 2011, 16, 831.   DOI   ScienceOn
23 Cui, Y. J. Pharm. Sci. 2011, 100, 2000.   DOI   ScienceOn
24 Tetko, I. V.; Bruneau, P.; Mewes, H. W.; Rohrer, D. C.; Poda, G. I. Drug Discov. Today 2006, 11, 700.   DOI   ScienceOn
25 Tarcsay, A.; Keseru, G. M. Expert Opin. Drug Metab. Toxicol. 2011, 7, 299.   DOI   ScienceOn
26 Speck-Planche, A.; Luan, F.; Cordeiro, M. N. Curr. Med. Chem. 2012, 19, 1635.   DOI
27 Tari, L. W. Methods Mol. Biol. 2012, 841, 1.   DOI   ScienceOn
28 Hunter, T. Cell 1995, 80, 225.   DOI   ScienceOn
29 Blume-Jensen, P.; Hunter, T. Nature 2001, 411, 355.   DOI   ScienceOn
30 Johnson, L. N.; Lewis, R. J. Chem. Rev. 2001, 101, 2209.   DOI   ScienceOn
31 Mazola, Y.; Rodriguez, R. Biotechnol. Aplic. 2008, 25, 7.
32 Sachsenmaier, C. Onkologie 2001, 24, 346.   DOI   ScienceOn
33 Rusconi, P.; Caiola, E.; Broggini, M. Curr. Med. Chem. 2012, 19, 1164.   DOI
34 Yu-Jing, Y. J.; Zhang, C. M.; Liu, Z. P. Anticancer Agents Med. Chem. 2012, 12, 391.   DOI
35 Besant, P. G.; Tan, E.; Attwood, P. V. Int. J. Biochem. Cell Biol. 2003, 35, 297.   DOI   ScienceOn
36 Manning, G.; Whyte, D. B. Science 2002, 298, 1912.   DOI   ScienceOn
37 Mitsudomi, T.; Yayabe, Y. FEBS J. 2010, 277, 301.   DOI   ScienceOn
38 Hirsch, F. R.; Dziadziuszko, R.; Varella-Garcia, M.; Franklin, W. A.; Bunn, P. A. J. Thor. Oncol. 2008, 3, S138.   DOI   ScienceOn
39 Takeuchi, K.; Ito, F. FEBS J. 2010, 277, 316.   DOI   ScienceOn