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[r20510] by bugman

Added system test for reading of a multi column formatted NMRPipe seriesTab file.

Progress sr #3043: (https://gna.org/support/index.php?3043) - support for NMRPipe seriesTab format *.ser.

Generated the reference data in Excell, for the system test.
The spectrum ID's are auto generated by supplying the keyword spectrum_id='auto'.
The first few tests was matched against integers rather than floats. Adding '.0' to the end of each number.

Spaces added after the commas in the self.assertAlmostEqual() calls.
The 2to3 conversion program (for Python 2 to Python 3 conversion) highlights this issue.

Troels E. Linnet provided this patch. Commit by: tlinset _aaattt_ gmail_dot_com

Signed-off-by: Edward d'Auvergne <edward@...>

2013-08-02 18:56:54 Tree
[r20509] by bugman

The ID of spins in seriesTab_multi.ser was not formatted correctly to SPARKY format.

Progress sr #3043: (https://gna.org/support/index.php?3043) - support for NMRPipe seriesTab format *.ser.

Troels E. Linnet provided this patch. Commit by: tlinset _aaattt_ gmail_dot_com

Signed-off-by: Edward d'Auvergne <edward _att_ nmr-relax _dott_ com>

2013-08-02 15:55:23 Tree
[r20508] by bugman

Replacing a pointer-reference structure to an empty creation of list of lists.

Progress sr #3043: (https://gna.org/support/index.php?3043) - support for NMRPipe seriesTab format *.ser.

Troels E. Linnet provided this patch. Commit by: tlinset _aaattt_ gmail_dot_com

Signed-off-by: Edward d'Auvergne <edward _att_ nmr-relax _dott_ com>

2013-08-02 15:35:57 Tree
[r20507] by bugman

Fix for unit test of nmrpipe.

Progress sr #3043: (https://gna.org/support/index.php?3043) - support for NMRPipe seriesTab format *.ser.

Troels E. Linnet provided this patch. Commit by: tlinset _aaattt_ gmail_dot_com

Signed-off-by: Edward d'Auvergne <edward _att_ nmr-relax _dott_ com>

2013-08-02 15:35:01 Tree
[r20506] by bugman

Adding NMR seriesTab data file for a multiple column / multiple spectrum formatted file.

This file is from https://gna.org/support/download.php?file_id=18618 attached to the support request
https://gna.org/support/?3043 by Troels Linnet.

This is if the command:
seriesTab -in ../../peaks.dat -out seriesTab_multi.ser -list nmrfiles.list -sum -dx 1 -dy 1

where nmrfiles.list contains file reference to 10 .ft2 files.

2013-08-02 12:00:20 Tree
[r20505] by bugman

Fix for handling reading spin of type heteronuc='NE1' and proton='HE1'.

Progress sr #3043: (https://gna.org/support/index.php?3043) - support for NMRPipe seriesTab format *.ser.

Troels E. Linnet provided this patch. Commit by: tlinset _aaattt_ gmail_dot_com

Signed-off-by: Edward d'Auvergne <edward _att_ nmr-relax _dott_ com>

2013-08-02 11:53:52 Tree
[r20504] by bugman

Fixed the extraction of NMRPipe seriestab data in pipe_control.spectrum.read().

Progress sr #3043: (https://gna.org/support/index.php?3043) - support for NMRPipe seriesTab format *.ser.

Troels E. Linnet provided this patch. Commit by: tlinset _aaattt_ gmail_dot_com

Signed-off-by: Edward d'Auvergne <edward _att_ nmr-relax _dott_ com>

2013-08-02 11:52:16 Tree
[r20503] by bugman

Modfied the intensity list to handle intensities for all spectra per spin.

Progress sr #3043: (https://gna.org/support/index.php?3043) - support for NMRPipe seriesTab format *.ser.

Troels E. Linnet provided this patch. Commit by: tlinset _aaattt_ gmail_dot_com

Signed-off-by: Edward d'Auvergne <edward _att_ nmr-relax _dott_ com>

2013-08-02 11:51:50 Tree
[r20502] by bugman

Fixed wrong reference to Sparky format.

Progress sr #3043: (https://gna.org/support/index.php?3043) - support for NMRPipe seriesTab format *.ser.

Troels E. Linnet provided this patch. Commit by: tlinset _aaattt_ gmail_dot_com

Signed-off-by: Edward d'Auvergne <edward _att_ nmr-relax _dott_ com>

2013-08-02 11:40:28 Tree
[r20501] by bugman

Removed the flag for single_spectrum.

Progress sr #3043: (https://gna.org/support/index.php?3043) - support for NMRPipe seriesTab format *.ser.

Troels E. Linnet provided this patch. Commit by: tlinnet _aaattt_ gmail_dot_com

Signed-off-by: Edward d'Auvergne <edward _att_ nmr-relax _dott_ com>

2013-08-02 11:39:53 Tree
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