relax / SVN archive Commit Log

Commit	Date
[r22328] by bugman The relaxation dispersion auto-analysis now creates the chi2.out text file. This is for more easily comparing the chi-squared values between analyses.	2014-02-26 11:04:16	Tree
[r22327] by bugman Editing of the dispersion GUI analysis tutorial in the manual. The whole section has been proofed and improved.	2014-02-26 11:03:22	Tree
[r22326] by tlinnet Renamed system test. Regarding bug #21344, (https://gna.org/bugs/index.php?21344) - Handling of in sparse acquired R1rho dataset with missing combinations of time and spin-lock field strengths. The previous test name was rubbish.	2014-02-26 10:10:23	Tree
[r22325] by tlinnet Added unit test for loop_time() for r1rho setup. Regarding bug #21344, (https://gna.org/bugs/index.php?21344) - Handling of in sparse acquired R1rho dataset with missing combinations of time and spin-lock field strengths.	2014-02-26 10:10:18	Tree
[r22324] by bugman Fixes for the Grace kex plot for the tutorial for dispersion GUI analysis. The values for the Grace plot were not correct.	2014-02-26 10:07:26	Tree
[r22323] by tlinnet Added unit test for count_relax_times() for and R1rho setup. Regarding bug #21344, (https://gna.org/bugs/index.php?21344) - Handling of in sparse acquired R1rho dataset with missing combinations of time and spin-lock field strengths.	2014-02-26 09:11:35	Tree
[r22322] by tlinnet Renamed previous disp_data unit tests, to reflect they were from a CPMG setup. Regarding bug #21344, (https://gna.org/bugs/index.php?21344) - Handling of in sparse acquired R1rho dataset with missing combinations of time and spin-lock field strengths.	2014-02-26 09:11:32	Tree
[r22321] by tlinnet Added system test for bug 21344. Regarding bug #21344, (https://gna.org/bugs/index.php?21344) - Handling of in sparse acquired R1rho dataset with missing combinations of time and spin-lock field strengths. This test will fail with: No intensity data could be found corresponding to the spectrometer frequency of 799.7773991 MHz, dispersion point of 431.0 and relaxation time of 0.14 s. Data for a dispersion point of 431.0 and time 0.14 does not exist, and so some of the looping in collecting data for calculation must be wrong. This behaviour and probably its solution is related to bug 21665, "Running a CPMG analysis with two fields at two delay times" (https://gna.org/bugs/index.php?21665).	2014-02-26 07:36:29	Tree
[r22320] by bugman More incorrect value fixes for the dispersion GUI tutorial in the manual. The pA and kex values were also somehow incorrect.	2014-02-25 20:58:40	Tree
[r22319] by bugman Fixes for some incorrectly reported results in the dispersion GUI tutorial in the manual. The non-clustered results had been incorrectly copied from the log messages.	2014-02-25 17:55:25	Tree

[r22328] by bugman

The relaxation dispersion auto-analysis now creates the chi2.out text file.

This is for more easily comparing the chi-squared values between analyses.

2014-02-26 11:04:16

Tree

[r22327] by bugman

Editing of the dispersion GUI analysis tutorial in the manual.

The whole section has been proofed and improved.

2014-02-26 11:03:22

Tree

[r22326] by tlinnet

Renamed system test.

Regarding bug #21344, (https://gna.org/bugs/index.php?21344) - Handling of in sparse acquired R1rho dataset with missing combinations of time and spin-lock field strengths.

The previous test name was rubbish.

2014-02-26 10:10:23

Tree

[r22325] by tlinnet

Added unit test for loop_time() for r1rho setup.

Regarding bug #21344, (https://gna.org/bugs/index.php?21344) - Handling of in sparse acquired R1rho dataset with missing combinations of time and spin-lock field strengths.

2014-02-26 10:10:18

Tree

[r22324] by bugman

Fixes for the Grace kex plot for the tutorial for dispersion GUI analysis.

The values for the Grace plot were not correct.

2014-02-26 10:07:26

Tree

[r22323] by tlinnet

Added unit test for count_relax_times() for and R1rho setup.

Regarding bug #21344, (https://gna.org/bugs/index.php?21344) - Handling of in sparse acquired R1rho dataset with missing combinations of time and spin-lock field strengths.

2014-02-26 09:11:35

Tree

[r22322] by tlinnet

Renamed previous disp_data unit tests, to reflect they were from a CPMG setup.

Regarding bug #21344, (https://gna.org/bugs/index.php?21344) - Handling of in sparse acquired R1rho dataset with missing combinations of time and spin-lock field strengths.

2014-02-26 09:11:32

Tree

[r22321] by tlinnet

Added system test for bug 21344.

Regarding bug #21344, (https://gna.org/bugs/index.php?21344) - Handling of in sparse acquired R1rho dataset with missing combinations of time and spin-lock field strengths.

This test will fail with:
No intensity data could be found corresponding to the spectrometer frequency of 799.7773991 MHz, dispersion point of 431.0 and relaxation time of 0.14 s.
Data for a dispersion point of 431.0 and time 0.14 does not exist, and so some of the looping in collecting data for calculation must be wrong.
This behaviour and probably its solution is related to bug 21665, "Running a CPMG analysis with two fields at two delay times" (https://gna.org/bugs/index.php?21665).

2014-02-26 07:36:29

Tree

[r22320] by bugman

More incorrect value fixes for the dispersion GUI tutorial in the manual.

The pA and kex values were also somehow incorrect.

2014-02-25 20:58:40

Tree

[r22319] by bugman

Fixes for some incorrectly reported results in the dispersion GUI tutorial in the manual.

The non-clustered results had been incorrectly copied from the log messages.

2014-02-25 17:55:25

Tree

relax SVN archive

Molecular dynamics by NMR data analysis

SVN archive Commit Log