pip install haddock-restraints

fromhaddock_restraintsimportInteractor,Air# Define binding regionsbinding_region_1=Interactor(id=1,chain="A",active=[10,11],passive=[])binding_region_2=Interactor(id=2,chain="B",active=[2,22],passive=[])# Define the relation between the regionsbinding_region_1.set_target(2)binding_region_2.set_target(1)# Set passive residues from active residuesbinding_region_1.set_passive_from_active()# Generate AIR tableair=Air(interactors=[binding_region_1,binding_region_2])tbl=air.gen_tbl()# Print the restraintsprint(tbl)