mx computational

UC San Diego / Drug Design Data Resource (D3R)

Info

Project Scientist at the Drug Design Data Resource (D3R) at UC San Diego. D3R runs the Grand Challenges, blind community benchmarks that evaluate structure-based drug design methods against newly-released protein-ligand co-crystal structures. D3R is a natural partner to wwPDB on ligand-structure quality.

Key Relationships

  • D3R Grand Challenges — ligand-pose prediction benchmarking platform
  • UC San Diego — host institution
  • Ligand Validation Workshop 2015 co-organizer
  • Links academic/industry drug discovery community to wwPDB validation discussions

Sources