DOVIS 2.0: an efficient and easy to use parallel virtual screening tool based on AutoDock 4.0
Author:
Publisher
Springer Science and Business Media LLC
Subject
General Chemistry
Link
http://link.springer.com/content/pdf/10.1186/1752-153X-2-18.pdf
Reference11 articles.
1. Ghosh S, Nie A, An J, Huang Z: Structure-based virtual screening of chemical libraries for drug discovery. Curr Opin Chem Biol. 2006, 10 (3): 194-202. 10.1016/j.cbpa.2006.04.002.
2. Goodsell DS, Morris GM, Olson AJ: Automated docking of flexible ligands: applications of AutoDock. J Mol Recognit. 1996, 9 (1): 1-5. 10.1002/(SICI)1099-1352(199601)9:1<1::AID-JMR241>3.0.CO;2-6.
3. Morris GM, Goodsell DS, Halliday RS, Huey R, Hart WE, Belew RK, Olson AJ: Automated docking using a Lamarckian genetic algorithm and an empirical binding free energy function. Journal of Computational Chemistry. 1998, 19 (14): 1639-1662. 10.1002/(SICI)1096-987X(19981115)19:14<1639::AID-JCC10>3.0.CO;2-B.
4. Zhang S, Kumar K, Jiang X, Wallqvist A, Reifman J: DOVIS: an implementation for high-throughput virtual screening using AutoDock. BMC Bioinformatics. 2008, 9: 126-10.1186/1471-2105-9-126.
5. OpenBabel. [http://openbabel.sourceforge.net]
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