title: e-Drug3D: 3D structure collections dedicated to drug repurposing and fragment-based drug design.
abstract: BACKGROUND
  In the drug discovery field, new uses for old drugs, selective optimization of side activities and fragment-based drug design (FBDD) have proved to be successful alternatives to high-throughput screening. e-Drug3D is a database of 3D chemical structures of drugs that provides several collections of ready-to-screen SD files of drugs and commercial drug fragments. They are natural inputs in studies dedicated to drug repurposing and FBDD.
  
  
  BACKGROUND
  e-Drug3D collections are freely available at http://chemoinfo.ipmc.cnrs.fr/e-drug3d.html either for download or for direct in silico web-based screenings.
authors.affiliation: Institut de Pharmacologie Moléculaire et Cellulaire, CNRS UMR7275, Université Nice-Sophia Antipolis, 660 route des lucioles, Valbonne, France.
authors.forename: Emilie
authors.initials: E
authors.lastname: Pihan
authors.forename: Lionel
authors.initials: L
authors.lastname: Colliandre
authors.forename: Jean-François
authors.initials: JF
authors.lastname: Guichou
authors.forename: Dominique
authors.initials: D
authors.lastname: Douguet
mesh_terms: D021983:Cyclophilins / Q000037:antagonists & inhibitors; D016208:Databases, Factual; D015195:Drug Design; D055808:Drug Discovery; D058492:Drug Repositioning; D006801:Humans; D020407:Internet; D008956:Models, Chemical; D004364:Pharmaceutical Preparations / Q000737:chemistry*
chemical_list: D004364:Pharmaceutical Preparations; D021983:Cyclophilins