Special Interest Group on Molecular Biomedical Informatics

Tip

Submit Ligand/Protein Files

Some preparation work need to be done before your submission, including hydrogen atoms recovery, charge calculation. If you have no idea about what PDBQ format is, please check here. And you could download sample PDBQ files if you just want to experience MEDock right now.

Ligand

PDB |PDBQ |PQR
Upload |Copy & Paste |PRODRG

 

Protein

PDB |PDBQ |PQR
Upload |Copy & Paste |PDB ID