Welcome to SINGLE Module

Single docking pose evaluation:

This module allow users to evaluate the performance of a docking pose corresponding to any peptide-ligand complex out of 57 peptide-ligand complexs used in this study. Since, the pose of original ligands are stored at this server,so users need to just select one of the peptide-ligand complex ID out of these 57 IDs and upload the docked pose of respective IDs, obtained by any of the docking methods. If you upload a predicted ligand that is not corresponding to the selected peptide-ligand IDs, then it will generate an error. Users can upload docked pose in any of three file format given below. After submitting,users will get evaluation result in the terms of one of the RMSD chosen by the users.. For more information visit help page help page



  Select the ID:     (Click on ? mark for help) NOTE: Allow PopUp

  Upload Docked Pose :  ( Example )

  Type of File: PDB      MOL2    SDF

  Type of RMSD:
Standard RMSD     
Symmetry-corrected RMSD   
Minimum-distance RMSD