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

Docking Result

CHEMBL392696_dpp4

Atoms: 252
Models: 9
Best Energy: -8.943 kcal/mol

Binding Energies:
  • Pose 1: -8.943 kcal/mol
  • Pose 2: -8.93 kcal/mol
  • Pose 3: -8.776 kcal/mol
  • Pose 4: -8.754 kcal/mol
  • Pose 5: -8.678 kcal/mol
  • Pose 6: -8.633 kcal/mol
  • Pose 7: -8.591 kcal/mol
  • Pose 8: -8.384 kcal/mol
  • Pose 9: -8.331 kcal/mol
CHEMBL392696_dpp4
Energy Plot
RMSD Scatter Plot