Pharmacophore-based virtual screening versus docking-based virtual screening: a benchmark comparison against eight targets-Reference-Cited by-同舟云学术

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Pharmacophore-based virtual screening versus docking-based virtual screening: a benchmark comparison against eight targets

Published:2009-11-23 Issue:12 Volume:30 Page:1694-1708
ISSN:1671-4083
Container-title:Acta Pharmacologica Sinica
language:en
Short-container-title:Acta Pharmacol Sin

Author:

Chen Zhi,Li Hong-lin,Zhang Qi-jun,Bao Xiao-guang,Yu Kun-qian,Luo Xiao-min,Zhu Wei-liang,Jiang Hua-liang

Publisher

Springer Science and Business Media LLC

Subject

Pharmacology (medical),Pharmacology,General Medicine

Link

http://www.nature.com/articles/aps2009159.pdf

Reference48 articles.

1. Stahl M, Guba W, Kansy M . Integrating molecular design resources within modern drug discovery research: the Roche experience. Drug Discov Today 2006; 11: 326–33.

2. Shoichet BK . Virtual screening of chemical libraries. Nature 2004; 432: 862–5.

3. Doman TN, McGovern SL, Witherbee BJ, Kasten TP, Kurumbail R, Stallings WC, et al. Molecular docking and high-throughput screening for novel inhibitors of protein tyrosine phosphatase-1B. J Med Chem 2002; 45: 2213–21.

4. Walters WP, Stahl MT, Murcko MA . Virtual screening — an overview. Drug Discov Today 1998; 3: 160–78.

5. McInnes C . Virtual screening strategies in drug discovery. Curr Opin Chem Biol 2007; 11: 494–502.

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