The Protein Data Bank (PDB), Its Related Services and Software Tools as Key Components for In Silico Guided Drug Discovery

Johannes Kirchmair, Patrick Markt, Simona Distinto, Daniela Schuster, Gudrun M. Spitzer, Klaus R. Liedl, Thierry Langer, Gerhard Wolber

Publications: Contribution to journalReviewPeer Reviewed

Original languageEnglish
Pages (from-to)7021-7040
Number of pages20
JournalJournal of Medicinal Chemistry
Volume51
Issue number22
DOIs
Publication statusPublished - 27 Nov 2008
Externally publishedYes

Austrian Fields of Science 2012

  • 301207 Pharmaceutical chemistry

Keywords

  • LIGAND-BINDING-SITES
  • WEB-ACCESSIBLE DATABASE
  • STRUCTURAL GENOMICS
  • STRUCTURE ALIGNMENT
  • CRYSTAL-STRUCTURES
  • MOLECULAR DOCKING
  • FORCE-FIELD
  • X-RAY
  • FUNCTIONAL ANNOTATION
  • AUTOMATIC-GENERATION

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