Relative binding affinity calculation
Protein uploading
Example
Select a protein file (PDB format).
Upload a protein without ligands
Reference ligand
Example
Select a ligand file (SDF format) as the reference ligand.
Upload the reference ligand
Ligands to be predicted
Example
Select ligand files (SDF format) as the ligands to be predicted.
Upload the ligands to be predicted
Start
Preview
Ligands to be predicted
No data
Reference ligand
No data