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  Workshop Index

On these web pages, you will find the material for the Drug Design Workshop on "Structure-based Ligand Design" that took place at the University of Uppsala on June 3-4, 2002.

This should help you to:

  • Use GRID for Structure-based Drug Design
  • Use COMBINE analysis to derive protein structure-based QSARs
  • Use UHBD to compute electrostatic binding free energies
  • Use 3DFS to do pharmacophore searches
  • Tutors: Rebecca Wade and Ting Wang

    All feedback is welcome! In particular, please let us know about errors that you spot.

    Rebecca Wade
    Ting Wang

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