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Bioinformatics. 2011 Jul 15;27(14):2018-20. doi: 10.1093/bioinformatics/btr333. Epub 2011 Jun 2.

The FAF-Drugs2 server: a multistep engine to prepare electronic chemical compound collections.

Author information

1
MTi, Ressource Parisienne en Bioinformatique Structurale, Institut National de Santé et de Recherche Médicale (INSERM), UMR-S 973 - Paris Diderot University, 75205 Paris, Cedex 13, France. david.lagorce@inserm.fr

Abstract

SUMMARY:

The FAF-Drugs2 server is a web application that prepares chemical compound libraries prior to virtual screening or that assists hit selection/lead optimization before chemical synthesis or ordering. The FAF-Drugs2 web server is an enhanced version of the FAF-Drugs2 package that now includes Pan Assay Interference Compounds detection. This online toolkit has been designed through a user-centered approach with emphasis on user-friendliness. This is a unique online tool allowing to prepare large compound libraries with in house or user-defined filtering parameters.

AVAILABILITY:

The FAF-Drugs2 server is freely available at http://bioserv.rpbs.univ-paris-diderot.fr/FAF-Drugs/.

PMID:
21636592
DOI:
10.1093/bioinformatics/btr333
[Indexed for MEDLINE]

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