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

Docking Result

CHEMBL3986470_dpp4

Atoms: 342
Models: 9
Best Energy: -8.171 kcal/mol

Binding Energies:
  • Pose 1: -8.171 kcal/mol
  • Pose 2: -7.866 kcal/mol
  • Pose 3: -7.779 kcal/mol
  • Pose 4: -7.733 kcal/mol
  • Pose 5: -7.672 kcal/mol
  • Pose 6: -7.671 kcal/mol
  • Pose 7: -7.571 kcal/mol
  • Pose 8: -7.526 kcal/mol
  • Pose 9: -7.451 kcal/mol
CHEMBL3986470_dpp4
Energy Plot
RMSD Scatter Plot