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

Docking Result

CHEMBL2385296_dpp4

Atoms: 288
Models: 9
Best Energy: -8.572 kcal/mol

Binding Energies:
  • Pose 1: -8.572 kcal/mol
  • Pose 2: -8.551 kcal/mol
  • Pose 3: -8.361 kcal/mol
  • Pose 4: -8.167 kcal/mol
  • Pose 5: -8.079 kcal/mol
  • Pose 6: -8.002 kcal/mol
  • Pose 7: -7.991 kcal/mol
  • Pose 8: -7.93 kcal/mol
  • Pose 9: -7.921 kcal/mol
CHEMBL2385296_dpp4
Energy Plot
RMSD Scatter Plot