receptor = rec.pdbqt
ligand = pep.pdbqt
out = vina_decoys.pdbqt
center_x = 12.465
center_y = 1.5735
center_z = 16.6915
size_x = 38.709
size_y = 25.5765
size_z = 39.0345
exhaustiveness = 64
cpu = 1 
