Opportunistic hydrogen bonding (OHB) in de novo drug design.

被引：0
|
作者：
Wipke, WT [1 ]
Arnold, J [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 | 1996年 / 212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：128 / COMP
页数：2
相关论文
共 50 条
  • [31] Chemical genomics: a challenge for de novo drug design
    Dean, P. M.
    MOLECULAR BIOTECHNOLOGY, 2007, 37 (03) : 237 - 245
  • [32] Generative Recurrent Networks for De Novo Drug Design
    Gupta, Anvita
    Mueller, Alex T.
    Huisman, Berend J. H.
    Fuchs, Jens A.
    Schneider, Petra
    Schneider, Gisbert
    MOLECULAR INFORMATICS, 2018, 37 (1-2)
  • [33] Chirality and drug design.
    Anderson, PS
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1997, 213 : 285 - MEDI
  • [34] PRO_LIGAND: An approach to de novo molecular design. 4. Application to the design of peptides
    J Comput Aided Mol Des, 3 (213):
  • [35] Artificial Intelligence in De novo Drug Design: Are We Still There?
    Kumar, Rajnish
    Sharma, Anju
    Alexiou, Athanasios
    Ashraf, Ghulam Md
    CURRENT TOPICS IN MEDICINAL CHEMISTRY, 2022, 22 (30) : 2483 - 2492
  • [36] Development and testing of a de novo drug-design algorithm
    Eric Pellegrini
    Martin J. Field
    Journal of Computer-Aided Molecular Design, 2003, 17 : 621 - 641
  • [37] LigBuilder 2: A Practical de Novo Drug Design Approach
    Yuan, Yaxia
    Pei, Jianfeng
    Lai, Luhua
    JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2011, 51 (05) : 1083 - 1091
  • [38] PREDICTION OF AFFINITY - THE KEY TO DE-NOVO DRUG DESIGN
    MARSHALL, GR
    HEAD, RD
    SMYTHE, ML
    GREEN, SM
    HO, CMW
    OPREA, TI
    FASEB JOURNAL, 1995, 9 (06): : A1253 - A1253
  • [39] LEADD: Lamarckian evolutionary algorithm for de novo drug design
    Kerstjens, Alan
    De Winter, Hans
    JOURNAL OF CHEMINFORMATICS, 2022, 14 (01)
  • [40] LEADD: Lamarckian evolutionary algorithm for de novo drug design
    Alan Kerstjens
    Hans De Winter
    Journal of Cheminformatics, 14
12345