What is CSD-Discovery?

CSD-Discovery provides valuable insights from high quality experimental crystal structure data in the CSD for computational and medicinal chemists. Capabilities of CSD-Discovery include everything in CSD-Core as well as:

• Ligand based drug design with conformer generation and ligand overlay
• Structure based drug design including SuperStar intermolecular interaction maps and CSD Full Interaction Maps (FIMS)
• Protein-ligand docking using GOLD
• API functions including conformer generation

More about CSD-Discovery

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Contact CCDC Support online, or by email.