mail[sr #3219] Help for inputting CPMG dispersion data from height list.


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Posted by Edward d Auvergne on March 10, 2015 - 10:18:
Update of sr #3219 (project relax):

                  Status:                    None => Done                   
             Open/Closed:                    Open => Closed                 
                 Summary: Help for inputting CPMG dispersion data from heigh
list => Help for inputting CPMG dispersion data from height list.

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Follow-up Comment #6:

The following pseudo-script will read the data out of the attached Sam.csv
file:

"""
# Create the data pipe.
pipe.create(pipe_name='test', pipe_type='relax_disp')

# Load the sequence.
sequence.read('Sam.csv', dir='.', res_num_col=1, sep=',')

# Name the spins so they can be matched to the assignments, and the isotope
for field strength scaling.
spin.name(name='N')
spin.isotope(isotope='15N')

# Load the peak intensities.
spectrum.read_intensities('Sam.csv', dir='.', spectrum_id='test',
int_method='height', int_col=2, res_num_col=1, sep=',')
"""

This is just a demonstration.  If using the GUI, just use the settings as
above.

    _______________________________________________________

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