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

Docking Result

CHEMBL3890161_dpp4

Atoms: 288
Models: 9
Best Energy: -8.146 kcal/mol

Binding Energies:
  • Pose 1: -8.146 kcal/mol
  • Pose 2: -8.137 kcal/mol
  • Pose 3: -8.113 kcal/mol
  • Pose 4: -7.827 kcal/mol
  • Pose 5: -7.786 kcal/mol
  • Pose 6: -7.756 kcal/mol
  • Pose 7: -7.741 kcal/mol
  • Pose 8: -7.601 kcal/mol
  • Pose 9: -7.53 kcal/mol
CHEMBL3890161_dpp4
Energy Plot
RMSD Scatter Plot