receptor = rec.pdbqt
ligand = pep.pdbqt
out = vina_decoys.pdbqt
center_x = 1.038
center_y = 0.248
center_z = 12.0585
size_x = 22.914
size_y = 23.061
size_z = 26.0445
exhaustiveness = 64
cpu = 1 
