receptor = rec.pdbqt
ligand = pep.pdbqt
out = vina_decoys.pdbqt
center_x = 24.1045
center_y = 22.9835
center_z = 24.58
size_x = 21.4545
size_y = 37.9515
size_z = 21.183
exhaustiveness = 64
cpu = 1 
