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

Docking Result

CHEMBL2206486_dpp4

Atoms: 351
Models: 9
Best Energy: -8.609 kcal/mol

Binding Energies:
  • Pose 1: -8.609 kcal/mol
  • Pose 2: -8.501 kcal/mol
  • Pose 3: -8.477 kcal/mol
  • Pose 4: -8.475 kcal/mol
  • Pose 5: -8.47 kcal/mol
  • Pose 6: -8.336 kcal/mol
  • Pose 7: -8.312 kcal/mol
  • Pose 8: -8.175 kcal/mol
  • Pose 9: -8.065 kcal/mol
CHEMBL2206486_dpp4
Energy Plot
RMSD Scatter Plot