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

Docking Result

CHEMBL5409066_dpp4

Atoms: 324
Models: 9
Best Energy: -9.698 kcal/mol

Binding Energies:
  • Pose 1: -9.698 kcal/mol
  • Pose 2: -9.672 kcal/mol
  • Pose 3: -9.478 kcal/mol
  • Pose 4: -9.297 kcal/mol
  • Pose 5: -9.15 kcal/mol
  • Pose 6: -9.091 kcal/mol
  • Pose 7: -8.961 kcal/mol
  • Pose 8: -8.864 kcal/mol
  • Pose 9: -8.736 kcal/mol
CHEMBL5409066_dpp4
Energy Plot
RMSD Scatter Plot