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

Docking Result

CHEMBL2069852_dpp4

Atoms: 297
Models: 9
Best Energy: -8.938 kcal/mol

Binding Energies:
  • Pose 1: -8.938 kcal/mol
  • Pose 2: -8.697 kcal/mol
  • Pose 3: -8.578 kcal/mol
  • Pose 4: -8.572 kcal/mol
  • Pose 5: -8.514 kcal/mol
  • Pose 6: -8.47 kcal/mol
  • Pose 7: -8.437 kcal/mol
  • Pose 8: -8.401 kcal/mol
  • Pose 9: -8.352 kcal/mol
CHEMBL2069852_dpp4
Energy Plot
RMSD Scatter Plot