Grid technologies empowering drug discovery

被引:28
|
作者
Chien, A
Foster, I
Goddette, D
机构
[1] Entropia, San Diego, CA 92121 USA
[2] Univ Calif San Diego, Dept Comp Sci & Engn, San Diego, CA 92039 USA
[3] Argonne Natl Lab, Div Math & Comp Sci, Argonne, IL 60439 USA
[4] Univ Chicago, Dept Comp Sci, Chicago, IL 60637 USA
关键词
D O I
10.1016/S1359-6446(02)02369-3
中图分类号
R9 [药学];
学科分类号
1007 ;
摘要
Grid technologies enable flexible coupling and sharing of computers, instruments and storage. Grids can provide technical solutions to the volume of data and computational demands associated with drug discovery by delivering larger computing capability (flexible resource sharing), providing coordinated access to large data resources and enabling novel online exploration (coupling computing, data and instruments online). Here, we illustrate this potential by describing two applications: the use of desktop PC grid technologies for virtual screening, and distributed X-ray structure reconstruction and online visualization.
引用
收藏
页码:S176 / S180
页数:5
相关论文
共 50 条
  • [1] Drug discovery using grid technologies and DrugML.
    Hamada, M
    Inagaki, Y
    Goto, H
    Tanaka, S
    Chuman, H
    [J]. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2004, 227 : U685 - U685
  • [2] Empowering the Smart Grid with Wireless Technologies
    Shen, Xuemin
    [J]. IEEE NETWORK, 2012, 26 (03): : 2 - 3
  • [3] Microfluidic technologies in drug discovery
    Pihl, J
    Karlsson, M
    Chiu, DT
    [J]. DRUG DISCOVERY TODAY, 2005, 10 (20) : 1377 - 1383
  • [4] Technologies for transporter drug discovery
    Weinglass, Adam B.
    Garcia, Maria L.
    Kaczorowski, Gregory L.
    [J]. CHANNELS, 2008, 2 (05) : 312 - 321
  • [5] Microdispensing technologies in drug discovery
    Rose, D
    [J]. DRUG DISCOVERY TODAY, 1999, 4 (09) : 411 - 419
  • [6] Repurposing Drugs: An Empowering Approach to Drug Discovery and Development
    Kumar, Sahil
    Roy, Vandana
    [J]. DRUG RESEARCH, 2023, 73 (09) : 481 - 490
  • [7] Discovery Technologies Ltd. - Drug discovery services
    Zinsli, H
    [J]. CHIMIA, 2000, 54 (04) : 169 - 170
  • [8] Drug discovery using grid technology
    Hamada, M
    Inagaki, Y
    Chuman, H
    [J]. SEVENTH INTERNATIONAL CONFERENCE ON HIGH PERFORMANCE COMPUTING AND GRID IN ASIA PACIFIC REGION, PROCEEDINGS, 2004, : 352 - 356
  • [9] The GRID/CPCA approach in drug discovery
    Rocha, Josmar R.
    Freitas, Renato F.
    Montanari, Carlos A.
    [J]. EXPERT OPINION ON DRUG DISCOVERY, 2010, 5 (04) : 333 - 346
  • [10] High Throughput Technologies in Drug Discovery
    Kundu, Bijoy
    [J]. COMBINATORIAL CHEMISTRY & HIGH THROUGHPUT SCREENING, 2011, 14 (10) : 829 - 829