DockMetrics
MOLECULAR DOCKING Inhibition Efficiency Index (IEI) and Selectivity Entropy Index (SEI)

Docking Result

CHEMBL360425_dpp4

Atoms: 414
Models: 9
Best Energy: -7.946 kcal/mol

Binding Energies:
  • Pose 1: -7.946 kcal/mol
  • Pose 2: -7.747 kcal/mol
  • Pose 3: -7.687 kcal/mol
  • Pose 4: -7.676 kcal/mol
  • Pose 5: -7.654 kcal/mol
  • Pose 6: -7.637 kcal/mol
  • Pose 7: -7.635 kcal/mol
  • Pose 8: -7.524 kcal/mol
  • Pose 9: -7.474 kcal/mol
CHEMBL360425_dpp4
Energy Plot
RMSD Scatter Plot