wengong-jin / abdockgen

MIT License
104 stars 22 forks source link

How do I run process_data.py on the antigen? #7

Open tony-res opened 10 months ago

tony-res commented 10 months ago

I'd like to run docking on my own PDB files. What I don't understand is how to include the pdb of the antigen.

python process_data.py ${pdb_file} ${heavy_chain_id} ${antigen_chain_id}

Is the ${pdb_file} meant to be for the antibody, the antigen, or both?

How could I do it with one file called antigen.pdb and another called antibody.pdb?