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

Docking Result

CHEMBL361107_dpp4

Atoms: 288
Models: 9
Best Energy: -8.589 kcal/mol

Binding Energies:
  • Pose 1: -8.589 kcal/mol
  • Pose 2: -8.523 kcal/mol
  • Pose 3: -8.481 kcal/mol
  • Pose 4: -8.472 kcal/mol
  • Pose 5: -8.42 kcal/mol
  • Pose 6: -8.398 kcal/mol
  • Pose 7: -8.349 kcal/mol
  • Pose 8: -8.151 kcal/mol
  • Pose 9: -8.135 kcal/mol
CHEMBL361107_dpp4
Energy Plot
RMSD Scatter Plot