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

Docking Result

CHEMBL2069839_dpp4

Atoms: 288
Models: 9
Best Energy: -8.315 kcal/mol

Binding Energies:
  • Pose 1: -8.315 kcal/mol
  • Pose 2: -8.301 kcal/mol
  • Pose 3: -8.257 kcal/mol
  • Pose 4: -8.111 kcal/mol
  • Pose 5: -8.105 kcal/mol
  • Pose 6: -8.034 kcal/mol
  • Pose 7: -8.033 kcal/mol
  • Pose 8: -8.011 kcal/mol
  • Pose 9: -8.01 kcal/mol
CHEMBL2069839_dpp4
Energy Plot
RMSD Scatter Plot