Subsections


pcs.back_calc

Image align_tensor Image applications-education

Synopsis

Back calculate the pseudo-contact shifts.

Defaults

pcs.back_calc(align_id=None)

Keyword arguments

align_id: The alignment ID string.

Description

This will back calculate the pseudo-contact shifts if the paramagnetic centre, temperature and magnetic field strength has been specified, an alignment tensor is present, and atomic positions have been loaded into the relax data store.




The relax user manual (PDF), created 2016-10-28.