메뉴 건너뛰기




Volumn 4360 LNBI, Issue , 2007, Pages 45-59

Grid-enabled high throughput virtual screening

Author keywords

Avian influenza; Large scale grids; Malaria; Virtual screening

Indexed keywords

DISEASES; DRUG PRODUCTS; MOLECULAR DYNAMICS; VIRTUAL REALITY;

EID: 34547482033     PISSN: 03029743     EISSN: 16113349     Source Type: Conference Proceeding    
DOI: 10.1007/978-3-540-69968-2_5     Document Type: Conference Paper
Times cited : (4)

References (30)
  • 1
    • 34547426393 scopus 로고    scopus 로고
    • BCG Estimate: A Revolution in R&D, The Impact of Genomics. (2001)
    • BCG Estimate: A Revolution in R&D, The Impact of Genomics. (2001)
  • 2
    • 0037107887 scopus 로고    scopus 로고
    • Structure-based virtual screening: An overview
    • Lyne, P.D.: Structure-based virtual screening: an overview. Drug Discov. Today 7 (2002) 1047-1055
    • (2002) Drug Discov. Today , vol.7 , pp. 1047-1055
    • Lyne, P.D.1
  • 3
    • 21544474149 scopus 로고    scopus 로고
    • Structural biology and drug discovery
    • Congreve, M., et al.: Structural biology and drug discovery. Drug Discov Today 10 (2005) 895-907
    • (2005) Drug Discov Today , vol.10 , pp. 895-907
    • Congreve, M.1
  • 4
    • 0242492756 scopus 로고    scopus 로고
    • Virtual drug discovery and development for neglected diseases through public-private partnerships
    • Nwaka, S., Ridley, RG.: Virtual drug discovery and development for neglected diseases through public-private partnerships. Nat Rev Drug Discov 2 (2003) 919-28
    • (2003) Nat Rev Drug Discov , vol.2 , pp. 919-928
    • Nwaka, S.1    Ridley, R.G.2
  • 5
    • 0037107933 scopus 로고    scopus 로고
    • Grid technologies empowering drug discovery
    • Chien, A., et al.: Grid technologies empowering drug discovery. Drug Discovery Today 7 (2002) 176-180
    • (2002) Drug Discovery Today , vol.7 , pp. 176-180
    • Chien, A.1
  • 6
    • 25144521010 scopus 로고    scopus 로고
    • Building an infrastructure for scientific Grid computing: Status and goals of the EGEE project. Philosophical Transactions: Mathematical
    • and http://www.eu-egee.org
    • Gagliardi, F., et al.: Building an infrastructure for scientific Grid computing: status and goals of the EGEE project. Philosophical Transactions: Mathematical, Physical and Engineering Sciences 363 (2005) 1729-1742 and http://www.eu-egee.org/
    • (2005) Physical and Engineering Sciences , vol.363 , pp. 1729-1742
    • Gagliardi, F.1
  • 7
    • 33744551693 scopus 로고    scopus 로고
    • Structure-based virtual screening of chemical libraries for drug discovery
    • Ghosh, S., et al.: Structure-based virtual screening of chemical libraries for drug discovery. Curr Opin Chem Biol. 10 (2006) 194-202
    • (2006) Curr Opin Chem Biol , vol.10 , pp. 194-202
    • Ghosh, S.1
  • 8
    • 0035521154 scopus 로고    scopus 로고
    • Aspartic proteases of plasmodium falciparum and other protozoa as drug targets
    • Coombs, G. H., et al.: Aspartic proteases of plasmodium falciparum and other protozoa as drug targets. Trends parasitol. 17 (2001) 532-537
    • (2001) Trends parasitol , vol.17 , pp. 532-537
    • Coombs, G.H.1
  • 9
    • 33751088166 scopus 로고    scopus 로고
    • Angew. New Antimalarial drugs
    • Weisner, J., et al.: Angew. New Antimalarial drugs, Chem. Int. 42 (2003) 5274-529
    • (2003) Chem. Int , vol.42 , pp. 5274-5529
    • Weisner, J.1
  • 11
    • 0032401982 scopus 로고    scopus 로고
    • Highthroughput virtual screening of historic collections on the file size, biological targets, and file diversity
    • Spencer, R.W.: Highthroughput virtual screening of historic collections on the file size, biological targets, and file diversity. Biotechnol. Bioeng 61 (1998) 61-67
    • (1998) Biotechnol. Bioeng , vol.61 , pp. 61-67
    • Spencer, R.W.1
  • 12
    • 7444230476 scopus 로고    scopus 로고
    • Grid as a bioinformatics tool
    • Jacq, N., et al.: Grid as a bioinformatics tool, Parallel Computing. 30 (2004) 1093-1107
    • (2004) Parallel Computing , vol.30 , pp. 1093-1107
    • Jacq, N.1
  • 14
    • 33646134539 scopus 로고    scopus 로고
    • Operating the LCG and EGEE production Grids for HEP
    • Bird, I., et al.: Operating the LCG and EGEE production Grids for HEP. Proceedings of the CHEP'04 Conference (2004)
    • (2004) Proceedings of the CHEP'04 Conference
    • Bird, I.1
  • 15
    • 42549172786 scopus 로고    scopus 로고
    • Breton, V., et al.: Grid added value to address malaria. Proceedings of the 6-th IEEE International Symposium on Cluster Computing and the Grid 40 (2006) and http://wisdom.healthgrid.org/.
    • Breton, V., et al.: Grid added value to address malaria. Proceedings of the 6-th IEEE International Symposium on Cluster Computing and the Grid 40 (2006) and http://wisdom.healthgrid.org/.
  • 16
    • 0025183708 scopus 로고
    • Basic local alignment search tool
    • Altschul, S.F., et al.: Basic local alignment search tool. J. Biol. Biol. 215 (1990) 403-410
    • (1990) J. Biol. Biol , vol.215 , pp. 403-410
    • Altschul, S.F.1
  • 18
    • 33750939806 scopus 로고    scopus 로고
    • Demonstration of In Silico Docking at a Large Scale on Grid Infrastructure
    • Jacq, N., et al.: Demonstration of In Silico Docking at a Large Scale on Grid Infrastructure. Studies in Health Technology and Informatics 120 (2006) 155-157
    • (2006) Studies in Health Technology and Informatics , vol.120 , pp. 155-157
    • Jacq, N.1
  • 19
    • 0030879653 scopus 로고    scopus 로고
    • Hemoglobin metabolism in the malaria parasite plasmodium falciparum
    • Francis, S. E., et al.: Hemoglobin metabolism in the malaria parasite plasmodium falciparum. Annu.Rev. Microbiol. 51 (1997)97-123
    • (1997) Annu.Rev. Microbiol , vol.51 , pp. 97-123
    • Francis, S.E.1
  • 20
    • 33845602649 scopus 로고    scopus 로고
    • Grid-enabled High-throughput in silico Screening against influenza A Neuraminidase
    • to be published in
    • Lee, H.-C., et al.: Grid-enabled High-throughput in silico Screening against influenza A Neuraminidase. to be published in IEEE Transaction on Nanobioscience (2006)
    • (2006) IEEE Transaction on Nanobioscience
    • Lee, H.-C.1
  • 21
    • 34547487907 scopus 로고    scopus 로고
    • DIANE - Distributed Analysis Environment for GRID-enabled Simulation and Analysis of Physics Data
    • Moscicki, J.T.: DIANE - Distributed Analysis Environment for GRID-enabled Simulation and Analysis of Physics Data. NSS IEEE 2004 (2004)
    • (2004) NSS IEEE
    • Moscicki, J.T.1
  • 22
    • 34547474191 scopus 로고    scopus 로고
    • Biomedical Applications on the GRID: Efficient Management of Parallel Jobs
    • Moscicki, J.T., et al.: Biomedical Applications on the GRID: Efficient Management of Parallel Jobs. NSS IEEE 2003 (2003)
    • (2003) NSS IEEE
    • Moscicki, J.T.1
  • 23
    • 3142579867 scopus 로고    scopus 로고
    • Genesis of a highly pathogenic and potentially pandemic H5N1 influenza virus in eastern Asia
    • Li, K.S., et al.: Genesis of a highly pathogenic and potentially pandemic H5N1 influenza virus in eastern Asia. Nature 430 (2004) 209-213
    • (2004) Nature , vol.430 , pp. 209-213
    • Li, K.S.1
  • 24
    • 29144528757 scopus 로고    scopus 로고
    • Oseltamivir Resistance during Treatment of Influenza A (H5N1) Infection
    • de Jong, M. D., et al.: Oseltamivir Resistance during Treatment of Influenza A (H5N1) Infection. N. Engl. J. Med. 353 (2005) 2667-72
    • (2005) N. Engl. J. Med , vol.353 , pp. 2667-2672
    • de Jong, M.D.1
  • 25
    • 11644261806 scopus 로고    scopus 로고
    • Automated Docking Using a Lamarckian Genetic Algorithm and Empirical Binding Free Energy Function
    • Morris, G. M., et al.: Automated Docking Using a Lamarckian Genetic Algorithm and Empirical Binding Free Energy Function. J. Computational Chemistry 19 (1998) 1639-1662
    • (1998) J. Computational Chemistry , vol.19 , pp. 1639-1662
    • Morris, G.M.1
  • 27
    • 0030599010 scopus 로고    scopus 로고
    • A fast flexible docking method using an incremental construction algorithm
    • Rarey, M., et al.: A fast flexible docking method using an incremental construction algorithm. J Mol Biol 261: (1996) 470-489
    • (1996) J Mol Biol , vol.261 , pp. 470-489
    • Rarey, M.1
  • 28
    • 16044374702 scopus 로고    scopus 로고
    • Structure and inhibition of plasmepsin II, A haemoglobin degrading enzyme from Plasmodium falciparum
    • Silva, A.M., et al.: Structure and inhibition of plasmepsin II, A haemoglobin degrading enzyme from Plasmodium falciparum. Proc. Natl. Acad. Sci. USA 93 (1996) 10034-10039
    • (1996) Proc. Natl. Acad. Sci. USA , vol.93 , pp. 10034-10039
    • Silva, A.M.1
  • 29
    • 0031320150 scopus 로고    scopus 로고
    • Computational approaches to molecular recognition
    • Lamb, M. L., Jorgensen, W. L.: Computational approaches to molecular recognition. Curr. Opin. Chem. Biol. 1 449(1997)
    • (1997) Curr. Opin. Chem. Biol , vol.1 , pp. 449
    • Lamb, M.L.1    Jorgensen, W.L.2
  • 30
    • 23444454552 scopus 로고    scopus 로고
    • The Amber biomolecular simulation programs
    • Case, D.A., et al.: The Amber biomolecular simulation programs. J. Computat. Chem. 26 (2005) 1668-1688
    • (2005) J. Computat. Chem , vol.26 , pp. 1668-1688
    • Case, D.A.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.