receptor = rec.pdbqt
ligand = pep.pdbqt
out = vina_decoys.pdbqt
center_x = 22.158
center_y = 104.0985
center_z = 18.433
size_x = 38.157
size_y = 41.1495
size_z = 25.722
exhaustiveness = 64
cpu = 1 
