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Molecular dynamics by NMR data analysis
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SVN archive Commit Log
| Commit | Date | |
|---|---|---|
|
[r22471]
by
tlinnet
Hardcoded the writing of R2eff as function of the tilt angle Theta, when using the function relax_disp.write_disp_curves(). Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. Theta values per spin will be written if the spin.model is in the list MODEL_LIST_R1RHO_FULL. |
2014-03-12 20:25:18 | Tree |
|
[r22470]
by
tlinnet
Extended systemtest Relax_disp.test_value_write_calc_rotating_frame_params_auto_analysis() to test the writing of theta values. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. |
2014-03-12 15:14:27 | Tree |
|
[r22469]
by
tlinnet
Added return of None values for function calc_rotating_frame_params() if spin is not selected. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. |
2014-03-12 15:14:25 | Tree |
|
[r22468]
by
tlinnet
Added writing of parameters theta and w_eff for an auto-analysis if model in MODEL_LIST_R1RHO_FULL. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. |
2014-03-12 15:14:23 | Tree |
|
[r22467]
by
tlinnet
Added systemtest Relax_disp.test_value_write_calc_rotating_frame_params_auto_analysis(). Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. This is to test the auto_analysis value.write function to write theta and w_eff values for an R1rho setup. |
2014-03-12 15:14:20 | Tree |
|
[r22466]
by
tlinnet
Moved unit test of value writing of calc_rotating_frame_params() into separete system tests. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. |
2014-03-12 12:05:03 | Tree |
|
[r22465]
by
tlinnet
Removed unused lines of code in unit test test_return_offset_data(). Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. |
2014-03-12 12:05:00 | Tree |
|
[r22464]
by
tlinnet
Fixed code duplication in relax_disp API, for calculation of theta and w_eff. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. |
2014-03-12 12:04:58 | Tree |
|
[r22463]
by
tlinnet
Added grace string to parameter description of theta and w_eff. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. |
2014-03-12 12:04:56 | Tree |
|
[r22462]
by
tlinnet
Fix for field count and added check for R1rho type in calc_rotating_frame_params(). Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. |
2014-03-12 12:04:53 | Tree |
