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Molecular dynamics by NMR data analysis
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SVN archive Commit Log
| Commit | Date | |
|---|---|---|
|
[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 This is if the command: 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 |
|
[r20500]
by
bugman
Started to create a script to create synthetic data for the TP02 dispersion model. This still needs a lot of work! |
2013-07-31 18:53:26 | Tree |
