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Molecular Docking

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Molecular Docking documentation

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Any publication using this code has to acknowledge the use of the xxx software, and the papers listed below:

Reference the web page http://brylinski.cct.lsu.edu/people/wei and cite the publication:

Feinstein WP, Brylinski M. 2014. eFindSite: Enhanced fingerprint-based virtual screening against predicted ligand binding sites in protein models. Mol Inform. 33(2):135-50.

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This site is maintained by the heterogeneous computing team of TESC (Technologies for Extreme Computing) at LSU.