paramagpy.dataparse.read_ccr

paramagpy.dataparse.read_ccr(fileName)[source]

Read cross-correlated relaxation values from file. These are typically Curie-spin cross Dipole-dipole relaxation rates The returned object is a dicationary. They keys are tuples of the form: ((sequence1, atomName1), (sequence2, atomName2)) Note that the first column is for the active nucleus undergoing relaxation and the second column is for the partner spin. The values are tuples of (value, error)

Parameters

fileName (str) – the path to the file

Returns

values – a dictionary containing the parsed data

Return type

paramagpy.dataparse.DataContainer

Examples

see paramagpy.dataparse.read_rdc() which has the similar file structure