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

Docking Result

CHEMBL184040_dpp4

Atoms: 396
Models: 9
Best Energy: -8.967 kcal/mol

Binding Energies:
  • Pose 1: -8.967 kcal/mol
  • Pose 2: -8.867 kcal/mol
  • Pose 3: -8.833 kcal/mol
  • Pose 4: -8.467 kcal/mol
  • Pose 5: -8.404 kcal/mol
  • Pose 6: -8.254 kcal/mol
  • Pose 7: -8.237 kcal/mol
  • Pose 8: -8.215 kcal/mol
  • Pose 9: -8.145 kcal/mol
CHEMBL184040_dpp4
Energy Plot
RMSD Scatter Plot