receptor = rec.pdbqt
ligand = pep.pdbqt
out = vina_decoys.pdbqt
center_x = 1.758
center_y = 14.034
center_z = -16.9455
size_x = 35.274
size_y = 23.49
size_z = 30.0345
exhaustiveness = 64
cpu = 1 
