Author: semor
Date: Fri Oct 17 20:22:59 2008
New Revision: 7799
URL: http://svn.gna.org/viewcvs/relax?rev=7799&view=rev
Log:
Added prototypes for the generic peak intensities file.
Only two files will be needed, instead of one file per delay. The first file
(generic_delay.txt)
will contain the different delays. The second file (generic_intensity.txt)
will contain the peak
intensities.
There may also be a way of including all this information in one single
file... maybe by putting
the delays in the header ? This would be even simpler for the user who would
only need to input 1
single file.
Added:
1.3/test_suite/shared_data/peak_lists/generic_delays.txt
1.3/test_suite/shared_data/peak_lists/generic_intensity.txt
Added: 1.3/test_suite/shared_data/peak_lists/generic_delays.txt
URL:
http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/peak_lists/generic_delays.txt?rev=7799&view=auto
==============================================================================
--- 1.3/test_suite/shared_data/peak_lists/generic_delays.txt (added)
+++ 1.3/test_suite/shared_data/peak_lists/generic_delays.txt Fri Oct 17
20:22:59 2008
@@ -1,0 +1,10 @@
+intensity_1 0.0109016
+intensity_2 0.0218032
+intensity_3 0.0436064
+intensity_4 0.0436064
+intensity_5 0.0872128
+intensity_6 0.1744260
+intensity_7 0.3488510
+intensity_8 0.6977020
+intensity_9 1.3954000
+intensity_10 1.9949900
Added: 1.3/test_suite/shared_data/peak_lists/generic_intensity.txt
URL:
http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/peak_lists/generic_intensity.txt?rev=7799&view=auto
==============================================================================
--- 1.3/test_suite/shared_data/peak_lists/generic_intensity.txt (added)
+++ 1.3/test_suite/shared_data/peak_lists/generic_intensity.txt Fri Oct 17
20:22:59 2008
@@ -1,0 +1,7 @@
+mol_name res_num res_name spin_num spin_name intensity_1
intensity_2 intensity_3 intensity_4 intensity_5 intensity_6
intensity_7 intensity_8 intensity_9 intensity_10
+
+None 20 GLY None N 1.0000
0.9714 0.9602 0.9626 0.8839 0.8327
0.7088 0.5098 0.2410 0.1116
+None 23 ALA None N 1.0000
0.9789 0.9751 0.9762 0.9074 0.8532
0.7089 0.5170 0.2444 0.1537
+None 34 CYS None N 1.0000
0.9659 0.9580 0.9559 0.9325 0.8460
0.7187 0.5303 0.2954 0.1683
+None 35 MET None N 1.0000
0.9657 0.9389 0.9366 0.9331 0.8683
0.7169 0.5357 0.2769 0.1625
+None 36 LYS None N 1.0000
1.0060 0.9556 0.9456 0.9077 0.8411
0.6788 0.4558 0.2448 0.1569
r7799 - in /1.3/test_suite/shared_data/peak_lists: generic_delays.txt generic_intensity.txt