Integration and utilization of different visualization methods and devices in a structure-based drug design process

被引:1
|
作者
Gröhn, MT [1 ]
Nyrönen, TH [1 ]
机构
[1] Helsinki Univ Technol, FIN-02150 Espoo, Finland
来源
关键词
visualization techniques; virtual environment; drug design;
D O I
10.1117/12.479676
中图分类号
TP [自动化技术、计算机技术];
学科分类号
0812 ;
摘要
Molecular visualization techniques are used in various stages in the computer-aided drug design process. Here, we report on utilization of a four wall immersive virtual room in the visualization of protein - drug complexes. The advantage of a virtual room compared to desktop graphics is that it provides a high-resolution large field of view, helping the observers of the visualization to dissect the individual important structural features more easily than while using only conventional molecular graphics visualizations.
引用
收藏
页码:11 / 18
页数:8
相关论文
共 50 条
  • [31] Serendipity meets precision: The integration of structure-based drug design and combinatorial chemistry for efficient drug discovery
    Salemme, FR
    Spurlino, J
    Bone, R
    STRUCTURE, 1997, 5 (03) : 319 - 324
  • [32] Importance of water in structure-based drug design
    Brewer, Mark L.
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2010, 239
  • [33] Recent advances in structure-based drug design
    Sherman, Woody
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2010, 239
  • [34] Quantum mechanics in structure-based drug design
    Peters, MB
    Raha, K
    Merz, KM
    CURRENT OPINION IN DRUG DISCOVERY & DEVELOPMENT, 2006, 9 (03) : 370 - 379
  • [35] Structure-based Drug Design Using NMR
    Jeeves, Mark
    Quill, Lee
    Overduin, Michael
    EMAGRES, 2015, 4 (02): : 231 - 240
  • [36] Influence of genomics on structure-based drug design
    Wang, BL
    Li, ZM
    Zang, HJ
    PROGRESS IN CHEMISTRY, 2003, 15 (06) : 505 - 511
  • [37] Advances in structure-based allosteric drug design
    Li, Rui
    He, Xinheng
    Wu, Chengwei
    Li, Mingyu
    Zhang, Jian
    CURRENT OPINION IN STRUCTURAL BIOLOGY, 2025, 90
  • [38] Recent developments in structure-based drug design
    Gerhard Klebe
    Journal of Molecular Medicine, 2000, 78 : 269 - 281
  • [39] STRUCTURE-BASED DRUG DESIGN 10 YEARS ON
    ROBERTUS, J
    NATURE STRUCTURAL BIOLOGY, 1994, 1 (06): : 352 - 354
  • [40] DXS as a target for structure-based drug design
    Gierse, Robin Matthias
    Redeem, Eswar
    Diamanti, Eleonora
    Wrenger, Carsten
    Groves, Matthew R.
    Hirsch, Anna K. H.
    FUTURE MEDICINAL CHEMISTRY, 2017, 9 (11) : 1277 - 1294