mailr14434 - /branches/inversion-recovery/test_suite/shared_data/curve_fitting/


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Posted by sebastien . morin on August 25, 2011 - 11:59:
Author: semor
Date: Thu Aug 25 11:59:20 2011
New Revision: 14434

URL: http://svn.gna.org/viewcvs/relax?rev=14434&view=rev
Log:
Included artificial data for one spin in the "exp_3param_inv_neg" test data 
files.


Modified:
    
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1100_ms
    
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1500_ms
    
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1950_ms
    
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1950_ms_bis
    
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_200_ms
    
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_2450_ms
    
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_450_ms
    
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_750_ms
    
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_750_ms_bis

Modified: 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1100_ms
URL: 
http://svn.gna.org/viewcvs/relax/branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1100_ms?rev=14434&r1=14433&r2=14434&view=diff
==============================================================================
--- 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1100_ms
 (original)
+++ 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1100_ms
 Thu Aug 25 11:59:20 2011
@@ -1,16 +1,3 @@
       Assignment         w1         w2   Data Height 
 
-         LEU3N-HN    122.454      8.397       410883 
-         GLY4N-HN    111.999      8.719      1501226 
-         SER5N-HN    115.085      8.176      1525836 
-         MET6N-HN    120.934      8.812      1160320 
-         ASP7N-HN    122.394      8.750       929084 
-         SER8N-HN    113.916      7.836      1278885 
-        GLU11N-HN    122.194      8.604       286239 
-        GLY12N-HN    110.525      9.028       560147 
-        SS332N-HN    113.353      7.052        26096 
-        SS345N-HN    112.775      6.865       284959 
-        SS346N-HN    112.678      6.838        14290 
-        SS358N-HN    111.682      6.885        75780 
-        SS361N-HN    111.037      6.831        23014 
-   ASN512ND2-HD22    113.256      6.932         6444 
+         LEU3N-HN    122.454      8.397       1.7

Modified: 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1500_ms
URL: 
http://svn.gna.org/viewcvs/relax/branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1500_ms?rev=14434&r1=14433&r2=14434&view=diff
==============================================================================
--- 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1500_ms
 (original)
+++ 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1500_ms
 Thu Aug 25 11:59:20 2011
@@ -1,16 +1,3 @@
       Assignment         w1         w2   Data Height 
 
-         LEU3N-HN    122.454      8.397       290285 
-         GLY4N-HN    111.999      8.719      1117820 
-         SER5N-HN    115.085      8.176      1116585 
-         MET6N-HN    120.934      8.812       832389 
-         ASP7N-HN    122.394      8.750       648883 
-         SER8N-HN    113.916      7.836       865260 
-        GLU11N-HN    122.194      8.604       156032 
-        GLY12N-HN    110.525      9.028       362307 
-        SS332N-HN    113.353      7.052        -7412 
-        SS345N-HN    112.775      6.865       218817 
-        SS346N-HN    112.678      6.838        18920 
-        SS358N-HN    111.682      6.885        43924 
-        SS361N-HN    111.037      6.831         2051 
-   ASN512ND2-HD22    113.256      6.932        -1672 
+         LEU3N-HN    122.454      8.397       7.3

Modified: 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1950_ms
URL: 
http://svn.gna.org/viewcvs/relax/branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1950_ms?rev=14434&r1=14433&r2=14434&view=diff
==============================================================================
--- 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1950_ms
 (original)
+++ 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1950_ms
 Thu Aug 25 11:59:20 2011
@@ -1,16 +1,3 @@
       Assignment         w1         w2   Data Height 
 
-         LEU3N-HN    122.454      8.397       283967 
-         GLY4N-HN    111.999      8.719      1124536 
-         SER5N-HN    115.085      8.176      1129172 
-         MET6N-HN    120.934      8.812       802894 
-         ASP7N-HN    122.394      8.750       626927 
-         SER8N-HN    113.916      7.836       866353 
-        GLU11N-HN    122.194      8.604       181328 
-        GLY12N-HN    110.525      9.028       357352 
-        SS332N-HN    113.353      7.052        15520 
-        SS345N-HN    112.775      6.865       240120 
-        SS346N-HN    112.678      6.838        26696 
-        SS358N-HN    111.682      6.885        60736 
-        SS361N-HN    111.037      6.831        -6574 
-   ASN512ND2-HD22    113.256      6.932        -8464 
+         LEU3N-HN    122.454      8.397       10.4

Modified: 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1950_ms_bis
URL: 
http://svn.gna.org/viewcvs/relax/branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1950_ms_bis?rev=14434&r1=14433&r2=14434&view=diff
==============================================================================
--- 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1950_ms_bis
 (original)
+++ 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_1950_ms_bis
 Thu Aug 25 11:59:20 2011
@@ -1,16 +1,3 @@
       Assignment         w1         w2   Data Height 
 
-         LEU3N-HN    122.454      8.397       154807 
-         GLY4N-HN    111.999      8.719       559841 
-         SER5N-HN    115.085      8.176       524645 
-         MET6N-HN    120.934      8.812       338864 
-         ASP7N-HN    122.394      8.750       258276 
-         SER8N-HN    113.916      7.836       314909 
-        GLU11N-HN    122.194      8.604        54240 
-        GLY12N-HN    110.525      9.028       120766 
-        SS332N-HN    113.353      7.052         2722 
-        SS345N-HN    112.775      6.865       116749 
-        SS346N-HN    112.678      6.838         1858 
-        SS358N-HN    111.682      6.885         2360 
-        SS361N-HN    111.037      6.831        -3910 
-   ASN512ND2-HD22    113.256      6.932       -12744 
+         LEU3N-HN    122.454      8.397       9.8

Modified: 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_200_ms
URL: 
http://svn.gna.org/viewcvs/relax/branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_200_ms?rev=14434&r1=14433&r2=14434&view=diff
==============================================================================
--- 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_200_ms
 (original)
+++ 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_200_ms
 Thu Aug 25 11:59:20 2011
@@ -1,15 +1,3 @@
       Assignment         w1         w2   Data Height 
 
-         LEU3N-HN    122.454      8.397       115007 
-         GLY4N-HN    111.999      8.719       414130 
-         SER5N-HN    115.085      8.176       377020 
-         MET6N-HN    120.934      8.812       234047 
-         ASP7N-HN    122.394      8.750       173301 
-         SER8N-HN    113.916      7.836       220471 
-        GLU11N-HN    122.194      8.604        23723 
-        GLY12N-HN    110.525      9.028        74952 
-        SS332N-HN    113.353      7.052         4592 
-        SS345N-HN    112.775      6.865       111934 
-        SS346N-HN    112.678      6.838          437 
-        SS358N-HN    111.682      6.885        34873 
-   ASN512ND2-HD22    113.256      6.932         7209 
+         LEU3N-HN    122.454      8.397       -33.5 

Modified: 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_2450_ms
URL: 
http://svn.gna.org/viewcvs/relax/branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_2450_ms?rev=14434&r1=14433&r2=14434&view=diff
==============================================================================
--- 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_2450_ms
 (original)
+++ 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_2450_ms
 Thu Aug 25 11:59:20 2011
@@ -1,16 +1,3 @@
       Assignment         w1         w2   Data Height 
 
-         LEU3N-HN    122.454      8.397       215867 
-         GLY4N-HN    111.999      8.719       855671 
-         SER5N-HN    115.085      8.176       849685 
-         MET6N-HN    120.934      8.812       586918 
-         ASP7N-HN    122.394      8.750       432114 
-         SER8N-HN    113.916      7.836       583142 
-        GLU11N-HN    122.194      8.604       120894 
-        GLY12N-HN    110.525      9.028       231921 
-        SS332N-HN    113.353      7.052        13615 
-        SS345N-HN    112.775      6.865       183713 
-        SS346N-HN    112.678      6.838         6341 
-        SS358N-HN    111.682      6.885        43565 
-        SS361N-HN    111.037      6.831        -3398 
-   ASN512ND2-HD22    113.256      6.932        -8590 
+         LEU3N-HN    122.454      8.397       12.0

Modified: 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_450_ms
URL: 
http://svn.gna.org/viewcvs/relax/branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_450_ms?rev=14434&r1=14433&r2=14434&view=diff
==============================================================================
--- 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_450_ms
 (original)
+++ 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_450_ms
 Thu Aug 25 11:59:20 2011
@@ -1,16 +1,3 @@
       Assignment         w1         w2   Data Height 
 
-         LEU3N-HN    122.454      8.397       129722 
-         GLY4N-HN    111.999      8.719       422375 
-         SER5N-HN    115.085      8.176       384180 
-         MET6N-HN    120.934      8.812       272100 
-         ASP7N-HN    122.394      8.750       174970 
-         SER8N-HN    113.916      7.836       218762 
-        GLU11N-HN    122.194      8.604        30412 
-        GLY12N-HN    110.525      9.028        90144 
-        SS332N-HN    113.353      7.052         5249 
-        SS345N-HN    112.775      6.865        96972 
-        SS346N-HN    112.678      6.838         7540 
-        SS358N-HN    111.682      6.885        26208 
-        SS361N-HN    111.037      6.831        -7862 
-   ASN512ND2-HD22    113.256      6.932         5287 
+         LEU3N-HN    122.454      8.397       -18.2

Modified: 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_750_ms
URL: 
http://svn.gna.org/viewcvs/relax/branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_750_ms?rev=14434&r1=14433&r2=14434&view=diff
==============================================================================
--- 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_750_ms
 (original)
+++ 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_750_ms
 Thu Aug 25 11:59:20 2011
@@ -1,16 +1,3 @@
       Assignment         w1         w2   Data Height 
 
-         LEU3N-HN    122.454      8.397       443875 
-         GLY4N-HN    111.999      8.719      1738701 
-         SER5N-HN    115.085      8.176      1775179 
-         MET6N-HN    120.934      8.812      1356507 
-         ASP7N-HN    122.394      8.750      1134894 
-         SER8N-HN    113.916      7.836      1536108 
-        GLU11N-HN    122.194      8.604       354200 
-        GLY12N-HN    110.525      9.028       731304 
-        SS332N-HN    113.353      7.052         -645 
-        SS345N-HN    112.775      6.865       273642 
-        SS346N-HN    112.678      6.838        25418 
-        SS358N-HN    111.682      6.885        79765 
-        SS361N-HN    111.037      6.831       -63109 
-   ASN512ND2-HD22    113.256      6.932       123725 
+         LEU3N-HN    122.454      8.397       -6.1

Modified: 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_750_ms_bis
URL: 
http://svn.gna.org/viewcvs/relax/branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_750_ms_bis?rev=14434&r1=14433&r2=14434&view=diff
==============================================================================
--- 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_750_ms_bis
 (original)
+++ 
branches/inversion-recovery/test_suite/shared_data/curve_fitting/T1_inv-recov_750_ms_bis
 Thu Aug 25 11:59:20 2011
@@ -1,16 +1,3 @@
       Assignment         w1         w2   Data Height 
 
-         LEU3N-HN    122.454      8.397       451270 
-         GLY4N-HN    111.999      8.719      1730899 
-         SER5N-HN    115.085      8.176      1775212 
-         MET6N-HN    120.934      8.812      1362665 
-         ASP7N-HN    122.394      8.750      1129805 
-         SER8N-HN    113.916      7.836      1536252 
-        GLU11N-HN    122.194      8.604       364597 
-        GLY12N-HN    110.525      9.028       710532 
-        SS332N-HN    113.353      7.052        36684 
-        SS345N-HN    112.775      6.865       267894 
-        SS346N-HN    112.678      6.838        45807 
-        SS358N-HN    111.682      6.885        66635 
-        SS361N-HN    111.037      6.831       -62849 
-   ASN512ND2-HD22    113.256      6.932       121398 
+         LEU3N-HN    122.454      8.397       -5.6




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