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

Docking Result

CHEMBL3357771_dpp4

Atoms: 306
Models: 9
Best Energy: -8.562 kcal/mol

Binding Energies:
  • Pose 1: -8.562 kcal/mol
  • Pose 2: -8.28 kcal/mol
  • Pose 3: -8.271 kcal/mol
  • Pose 4: -8.264 kcal/mol
  • Pose 5: -8.208 kcal/mol
  • Pose 6: -8.129 kcal/mol
  • Pose 7: -8.08 kcal/mol
  • Pose 8: -8.019 kcal/mol
  • Pose 9: -7.96 kcal/mol
CHEMBL3357771_dpp4
Energy Plot
RMSD Scatter Plot