receptor = rec.pdbqt
ligand = pep.pdbqt
out = vina_decoys.pdbqt
center_x = -0.829
center_y = 14.361
center_z = -4.1555
size_x = 40.068
size_y = 47.874
size_z = 17.9445
exhaustiveness = 64
cpu = 1 
