Author: bugman
Date: Sun Nov 30 01:03:10 2014
New Revision: 26869
URL: http://svn.gna.org/viewcvs/relax?rev=26869&view=rev
Log:
Changed the peak intensities for Gly 4 in the synthetic inversion recovery
Sparky lists.
The values have been changed to match that determined from the calc.py
script. The replicate
spectra intensities are simply the calculated intensity +/-1, to preserve the
average.
Modified:
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1100_ms.list
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1500_ms.list
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1950_ms.list
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1950_ms_bis.list
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_200_ms.list
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_2450_ms.list
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_450_ms.list
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_750_ms.list
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_750_ms_bis.list
Modified:
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1100_ms.list
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1100_ms.list?rev=26869&r1=26868&r2=26869&view=diff
==============================================================================
---
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1100_ms.list
(original)
+++
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1100_ms.list
Sun Nov 30 01:03:10 2014
@@ -1,4 +1,4 @@
Assignment w1 w2 Data Height
LEU3N-HN 122.454 8.397 1.7
- GLY4N-HN 111.999 8.719 8.2
+ GLY4N-HN 111.999 8.719 13.985940941024490
Modified:
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1500_ms.list
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1500_ms.list?rev=26869&r1=26868&r2=26869&view=diff
==============================================================================
---
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1500_ms.list
(original)
+++
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1500_ms.list
Sun Nov 30 01:03:10 2014
@@ -1,4 +1,4 @@
Assignment w1 w2 Data Height
LEU3N-HN 122.454 8.397 7.3
- GLY4N-HN 111.999 8.719 13.4
+ GLY4N-HN 111.999 8.719 17.041033353352404
Modified:
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1950_ms.list
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1950_ms.list?rev=26869&r1=26868&r2=26869&view=diff
==============================================================================
---
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1950_ms.list
(original)
+++
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1950_ms.list
Sun Nov 30 01:03:10 2014
@@ -1,4 +1,4 @@
Assignment w1 w2 Data Height
LEU3N-HN 122.454 8.397 10.4
- GLY4N-HN 111.999 8.719 17.0
+ GLY4N-HN 111.999 8.719 20.110170853085208
Modified:
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1950_ms_bis.list
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1950_ms_bis.list?rev=26869&r1=26868&r2=26869&view=diff
==============================================================================
---
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1950_ms_bis.list
(original)
+++
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_1950_ms_bis.list
Sun Nov 30 01:03:10 2014
@@ -1,4 +1,4 @@
Assignment w1 w2 Data Height
LEU3N-HN 122.454 8.397 9.8
- GLY4N-HN 111.999 8.719 17.5
+ GLY4N-HN 111.999 8.719 18.110170853085208
Modified:
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_200_ms.list
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_200_ms.list?rev=26869&r1=26868&r2=26869&view=diff
==============================================================================
---
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_200_ms.list
(original)
+++
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_200_ms.list
Sun Nov 30 01:03:10 2014
@@ -1,4 +1,4 @@
Assignment w1 w2 Data Height
LEU3N-HN 122.454 8.397 -33.5
- GLY4N-HN 111.999 8.719 -18.9
+ GLY4N-HN 111.999 8.719 -1.598835831996603
Modified:
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_2450_ms.list
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_2450_ms.list?rev=26869&r1=26868&r2=26869&view=diff
==============================================================================
---
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_2450_ms.list
(original)
+++
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_2450_ms.list
Sun Nov 30 01:03:10 2014
@@ -1,4 +1,4 @@
Assignment w1 w2 Data Height
LEU3N-HN 122.454 8.397 12.0
- GLY4N-HN 111.999 8.719 19.4
+ GLY4N-HN 111.999 8.719 20.414028137849488
Modified:
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_450_ms.list
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_450_ms.list?rev=26869&r1=26868&r2=26869&view=diff
==============================================================================
---
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_450_ms.list
(original)
+++
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_450_ms.list
Sun Nov 30 01:03:10 2014
@@ -1,4 +1,4 @@
Assignment w1 w2 Data Height
LEU3N-HN 122.454 8.397 -18.2
- GLY4N-HN 111.999 8.719 -8.3
+ GLY4N-HN 111.999 8.719 4.517552428780309
Modified:
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_750_ms.list
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_750_ms.list?rev=26869&r1=26868&r2=26869&view=diff
==============================================================================
---
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_750_ms.list
(original)
+++
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_750_ms.list
Sun Nov 30 01:03:10 2014
@@ -1,4 +1,4 @@
Assignment w1 w2 Data Height
LEU3N-HN 122.454 8.397 -6.1
- GLY4N-HN 111.999 8.719 0.9
+ GLY4N-HN 111.999 8.719 8.802910207782025
Modified:
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_750_ms_bis.list
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_750_ms_bis.list?rev=26869&r1=26868&r2=26869&view=diff
==============================================================================
---
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_750_ms_bis.list
(original)
+++
trunk/test_suite/shared_data/curve_fitting/inversion_recovery/T1_inv-recov_750_ms_bis.list
Sun Nov 30 01:03:10 2014
@@ -1,4 +1,4 @@
Assignment w1 w2 Data Height
LEU3N-HN 122.454 8.397 -5.6
- GLY4N-HN 111.999 8.719 0.7
+ GLY4N-HN 111.999 8.719 10.802910207782025
r26869 - /trunk/test_suite/shared_data/curve_fitting/inversion_recovery/