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

Docking Result

CHEMBL1186902_dpp4

Atoms: 342
Models: 9
Best Energy: -6.589 kcal/mol

Binding Energies:
  • Pose 1: -6.589 kcal/mol
  • Pose 2: -6.488 kcal/mol
  • Pose 3: -6.447 kcal/mol
  • Pose 4: -6.238 kcal/mol
  • Pose 5: -6.168 kcal/mol
  • Pose 6: -6.134 kcal/mol
  • Pose 7: -6.113 kcal/mol
  • Pose 8: -6.112 kcal/mol
  • Pose 9: -5.851 kcal/mol
CHEMBL1186902_dpp4
Energy Plot
RMSD Scatter Plot