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Identify drug repurposing candidates by mining the protein data bank.
Brief Bioinform. 2011 Jul;12(4):336-40. doi: 10.1093/bib/bbr017. Epub 2011 Apr 21.
Brief Bioinform. 2011.
PMID: 21768131
A simple and fuzzy method to align and compare druggable ligand-binding sites.
Schalon C, Surgand JS, Kellenberger E, Rognan D.
Schalon C, et al. Among authors: surgand js.
Proteins. 2008 Jun;71(4):1755-78. doi: 10.1002/prot.21858.
Proteins. 2008.
PMID: 18175308
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A chemogenomic analysis of the transmembrane binding cavity of human G-protein-coupled receptors.
Surgand JS, Rodrigo J, Kellenberger E, Rognan D.
Surgand JS, et al.
Proteins. 2006 Feb 1;62(2):509-38. doi: 10.1002/prot.20768.
Proteins. 2006.
PMID: 16294340
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