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

Docking Result

CHEMBL474409_dpp4

Atoms: 243
Models: 9
Best Energy: -7.647 kcal/mol

Binding Energies:
  • Pose 1: -7.647 kcal/mol
  • Pose 2: -7.474 kcal/mol
  • Pose 3: -7.463 kcal/mol
  • Pose 4: -7.284 kcal/mol
  • Pose 5: -7.267 kcal/mol
  • Pose 6: -7.198 kcal/mol
  • Pose 7: -7.167 kcal/mol
  • Pose 8: -7.148 kcal/mol
  • Pose 9: -7.077 kcal/mol
CHEMBL474409_dpp4
Energy Plot
RMSD Scatter Plot