Hi, I am using the sample script for noe analysis, which runs fine aka calculates the NOE values. But following two commands don't work,
relax> grace.write(x_data_type='res_num', y_data_type='ref', spin_id=None, plot_data='value', file='600NOEcAMP_ref.agr', dir='grace', force=True, norm=False) Opening the file 'grace/600NOEcAMP_ref.agr' for writing. RelaxWarning: No data could be found, creating an empty file. relax> grace.write(x_data_type='res_num', y_data_type='sat', spin_id=None, plot_data='value', file='600NOEcAMP_sat.agr', dir='grace', force=True, norm=False) Opening the file 'grace/600NOEcAMP_sat.agr' for writing. RelaxWarning: No data could be found, creating an empty file. The NOE plot is fine. Any suggestion? Justin -- Justin Lecher Institute of Complex Systems ICS-6 Structural Biochemistry Research Centre Juelich 52425 Juelich, Germany phone: +49 2461 61 2117
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