Short description of the directories contained in this data archive. simulations_3spin_cs/ data for simulations for 3 spin systems with chemical shift simulations_3spin_exp/ data for simulations for 3 spin systems that match exp. data simulations_3spin_nocs/ data for simulations for 3 spin systems without chemical shift simulations_4_5spin_nocs/ data for simulations for 4/5 spin systems without chemical shift