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Resources

The Molecular Modelling group is developing and maintaining several resources for molecular modeling and in silico drug design:

 

  • Swiss_Zndb, a collection of 3D structures of Zn containing ligand-protein complexes to benchmark MM or QM/MM docking software.
  • Swiss_Hemedb.zip, a collection of 3D structures of Heme containing ligand-protein complexes to benchmark MM or QM/MM docking software.
 

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