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

Docking Result

CHEMBL1683140_dpp4

Atoms: 225
Models: 9
Best Energy: -7.357 kcal/mol

Binding Energies:
  • Pose 1: -7.357 kcal/mol
  • Pose 2: -7.215 kcal/mol
  • Pose 3: -7.212 kcal/mol
  • Pose 4: -7.115 kcal/mol
  • Pose 5: -6.844 kcal/mol
  • Pose 6: -6.8 kcal/mol
  • Pose 7: -6.717 kcal/mol
  • Pose 8: -6.697 kcal/mol
  • Pose 9: -6.663 kcal/mol
CHEMBL1683140_dpp4
Energy Plot
RMSD Scatter Plot