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

Docking Result

CHEMBL256928_dpp4

Atoms: 288
Models: 9
Best Energy: -7.822 kcal/mol

Binding Energies:
  • Pose 1: -7.822 kcal/mol
  • Pose 2: -7.701 kcal/mol
  • Pose 3: -7.546 kcal/mol
  • Pose 4: -7.513 kcal/mol
  • Pose 5: -7.469 kcal/mol
  • Pose 6: -7.427 kcal/mol
  • Pose 7: -7.22 kcal/mol
  • Pose 8: -7.116 kcal/mol
  • Pose 9: -7.104 kcal/mol
CHEMBL256928_dpp4
Energy Plot
RMSD Scatter Plot