Docking flexible ligands using QSD shape complementarity.

被引：0
|
作者：
Wipke, WT [1 ]
Goldman, B [1 ]
机构：
[1] UNIV CALIF SANTA CRUZ,DEPT CHEM,MOL ENGN LAB,SANTA CRUZ,CA 95064
来源：
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 1997年 / 213卷
关键词：
D O I：
暂无
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
引用
收藏
页码：341 / COMP
页数：1
相关论文
共 50 条
  • [41] Assessment of Flexible Shape Complementarity: New Opportunities to Explain and Induce Selectivity in Ligands of Protein Tyrosine Phosphatase 1B
    Nass, Alexandra
    Schaller, David
    Wolber, Gerhard
    MOLECULAR INFORMATICS, 2019, 38 (05)
  • [42] PUZZLE - A NEW METHOD FOR AUTOMATED PROTEIN DOCKING BASED ON SURFACE SHAPE COMPLEMENTARITY
    HELMERCITTERICH, M
    TRAMONTANO, A
    JOURNAL OF MOLECULAR BIOLOGY, 1994, 235 (03) : 1021 - 1031
  • [43] Flexible docking of ligands into synthetic receptors using a two-sided incremental construction algorithm
    Steffen, Andreas
    Kaemper, Andreas
    Lengauer, Thomas
    JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2006, 46 (04) : 1695 - 1703
  • [44] Flexible "induced fit" docking of ligands to enzyme active sites
    Rao, SN
    Farid, R
    Beard, H
    Day, T
    Shelley, M
    Perry, J
    Krystek, S
    Nayeem, A
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2005, 229 : U795 - U795
  • [45] POSIT: Flexible Shape-Guided Docking For Pose Prediction
    Kelley, Brian P.
    Brown, Scott P.
    Warren, Gregory L.
    Muchmore, Steven W.
    JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2015, 55 (08) : 1771 - 1780
  • [46] Identification of Protein Interaction Partners from Shape Complementarity Molecular Cross-Docking
    Laine, Elodie
    Carbone, Alessandra
    NEW TRENDS IN IMAGE ANALYSIS AND PROCESSING - ICIAP 2013, 2013, 8158 : 318 - 325
  • [47] Flexible docking in solution using metadynamics
    Gervasio, FL
    Laio, A
    Parrinello, M
    JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2005, 127 (08) : 2600 - 2607
  • [48] Flexible docking in solution using metadynamics
    Gervasio, F.L. (fgervasi@phys.chem.ethz.ch), 1600, American Chemical Society (127):
  • [49] A dynamic niching genetic algorithm strategy for docking highly flexible ligands
    de Magalhaes, Camila Silva
    Almeida, Diogo Marinho
    Correa Barbosa, Helio Jose
    Dardenne, Laurent Emmanuel
    INFORMATION SCIENCES, 2014, 289 : 206 - 224
  • [50] MOLECULAR DOCKING USING SHAPE DESCRIPTORS
    SHOICHET, BK
    BODIAN, DL
    KUNTZ, ID
    JOURNAL OF COMPUTATIONAL CHEMISTRY, 1992, 13 (03) : 380 - 397
12345