MOLECULAR RECOGNITION - OPTIMIZED SEARCHING THROUGH ROTATIONAL 3-SPACE FOR PATTERN MATCHES ON MOLECULAR-SURFACES

被引：47
|
作者：
DEAN, PM [1 ]
CHAU, PL [1 ]
机构：
[1] UNIV CAMBRIDGE,CAVENDISH LAB,DEPT PHYS,CAMBRIDGE CB3 0HE,ENGLAND
来源：
JOURNAL OF MOLECULAR GRAPHICS | 1987年 / 5卷 / 03期
关键词：
D O I：
10.1016/0263-7855(87)80064-4
中图分类号：
Q5 [生物化学];
学科分类号：
071010 ; 081704 ;
摘要：
引用
收藏
页码：152 / &
相关论文
共 50 条
  • [21] Characterization of molecular recognition of Phosphoinositide-3-kinase α inhibitor through molecular dynamics simulation
    Yiping Li
    Jiye Zhang
    Delong He
    Qi Liang
    Yawen Wang
    Journal of Molecular Modeling, 2012, 18 : 1907 - 1916
  • [22] Selective molecular recognition on calixarene-functionalized 3D surfaces
    Zhang, Fan
    Sun, Yue
    Tian, Demei
    Shin, Weon Sup
    Kim, Jong Seung
    Li, Haibing
    CHEMICAL COMMUNICATIONS, 2016, 52 (86) : 12685 - 12693
  • [23] Molecular basis for invertebrate innate immune recognition of (1→3)-β-D-glucan as a pathogen-associated molecular pattern
    Muta, T.
    CURRENT PHARMACEUTICAL DESIGN, 2006, 12 (32) : 4155 - 4161
  • [24] Supramolecular Adhesives to Hard Surfaces: Adhesion Between Host Hydrogels and Guest Glass Substrates Through Molecular Recognition
    Takashima, Yoshinori
    Sahara, Taiga
    Sekine, Tomoko
    Kakuta, Takahiro
    Nakahata, Masaki
    Otsubo, Miyuki
    Kobayashi, Yuichiro
    Harada, Akira
    MACROMOLECULAR RAPID COMMUNICATIONS, 2014, 35 (19) : 1646 - 1652
  • [25] Searching the conformational space of cyclic molecules: A molecular mechanics and density functional theory study of 9-crown-3
    Jagannadh, B
    Sarma, JARP
    JOURNAL OF PHYSICAL CHEMISTRY A, 1999, 103 (50): : 10993 - 10997
  • [26] ALADDIN - AN INTEGRATED TOOL FOR COMPUTER-ASSISTED MOLECULAR DESIGN AND PHARMACOPHORE RECOGNITION FROM GEOMETRIC, STERIC, AND SUBSTRUCTURE SEARCHING OF 3-DIMENSIONAL MOLECULAR-STRUCTURES
    VANDRIE, JH
    WEININGER, D
    MARTIN, YC
    JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN, 1989, 3 (03) : 225 - 251
  • [27] Molecular insights into odorant recognition: Rotational and docking studies of 3-methylcyclopentane-1,2-dione and its monohydrate
    Li, Meng
    Wang, Juan
    Herbers, Sven
    Wang, Xiujuan
    Wang, Hao
    Gou, Qian
    Grabow, Jens-Uwe
    Zhong, Geng
    JOURNAL OF CHEMICAL PHYSICS, 2025, 162 (10):
  • [28] Real-space imaging with pattern recognition of a ligand-protected Ag374 nanocluster at sub-molecular resolution
    Zhou, Qin
    Kaappa, Sami
    Malola, Sami
    Lu, Hui
    Guan, Dawei
    Li, Yajuan
    Wang, Haochen
    Xie, Zhaoxiong
    Ma, Zhibo
    Hakkinen, Hannu
    Zheng, Nanfeng
    Yang, Xueming
    Zheng, Lansun
    NATURE COMMUNICATIONS, 2018, 9
  • [29] Real-space imaging with pattern recognition of a ligand-protected Ag374 nanocluster at sub-molecular resolution
    Qin Zhou
    Sami Kaappa
    Sami Malola
    Hui Lu
    Dawei Guan
    Yajuan Li
    Haochen Wang
    Zhaoxiong Xie
    Zhibo Ma
    Hannu Häkkinen
    Nanfeng Zheng
    Xueming Yang
    Lansun Zheng
    Nature Communications, 9
  • [30] Molecular modeling studies of the D3 receptor and discovery of new D3 ligands through 3D-database pharmacophore searching.
    Varady, J
    Wang, SM
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2000, 220 : U576 - U576
12345