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

Docking Result

CHEMBL369894_dpp4

Atoms: 297
Models: 9
Best Energy: -8.462 kcal/mol

Binding Energies:
  • Pose 1: -8.462 kcal/mol
  • Pose 2: -8.396 kcal/mol
  • Pose 3: -8.351 kcal/mol
  • Pose 4: -8.225 kcal/mol
  • Pose 5: -8.149 kcal/mol
  • Pose 6: -8.142 kcal/mol
  • Pose 7: -8.073 kcal/mol
  • Pose 8: -8.039 kcal/mol
  • Pose 9: -8.027 kcal/mol
CHEMBL369894_dpp4
Energy Plot
RMSD Scatter Plot