Author: bugman
Date: Fri Aug 2 14:00:20 2013
New Revision: 20506
URL: http://svn.gna.org/viewcvs/relax?rev=20506&view=rev
Log:
Adding NMR seriesTab data file for a multiple column / multiple spectrum
formatted file.
This file is from https://gna.org/support/download.php?file_id=18618 attached
to the support request
https://gna.org/support/?3043 by Troels Linnet.
This is if the command:
seriesTab -in ../../peaks.dat -out seriesTab_multi.ser -list
nmrfiles.list -sum -dx 1 -dy 1
where nmrfiles.list contains file reference to 10 .ft2 files.
Added:
trunk/test_suite/shared_data/peak_lists/seriesTab_multi.ser
Added: trunk/test_suite/shared_data/peak_lists/seriesTab_multi.ser
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/peak_lists/seriesTab_multi.ser?rev=20506&view=auto
==============================================================================
--- trunk/test_suite/shared_data/peak_lists/seriesTab_multi.ser (added)
+++ trunk/test_suite/shared_data/peak_lists/seriesTab_multi.ser Fri Aug 2
14:00:20 2013
@@ -1,0 +1,23 @@
+REMARK SeriesTab Input: ../../peaks.dat Output: seriesTab_multi.ser
+REMARK Mode: Summation Dimensions: 2
+REMARK Input Region: X +/- 1 X-ZF: 3
+REMARK Analysis Region: X +/- 1
+REMARK Input Region: Y +/- 1 Y-ZF: 3
+REMARK Analysis Region: Y +/- 1
+
+VARS INDEX X_AXIS Y_AXIS X_PPM Y_PPM VOL ASS Z_A0 Z_A1 Z_A2 Z_A3 Z_A4 Z_A5
Z_A6 Z_A7 Z_A8 Z_A9
+FORMAT %5d %9.3f %9.3f %8.3f %8.3f %+e %s %7.4f %7.4f %7.4f %7.4f %7.4f
%7.4f %7.4f %7.4f %7.4f %7.4f
+
+NULLVALUE -666
+NULLSTRING *
+
+ 1 295.826 56.316 8.117 126.189 +7.711845e+05 ?-? 1.0000
1.2008 1.1962 1.2012 1.2115 1.2011 1.1976 1.2019 1.1854 1.2083
+ 2 272.690 83.965 8.343 123.204 +2.046416e+06 ?-? 1.0000
1.1949 1.1948 1.1961 1.1970 1.1953 1.1954 1.1973 1.2006 1.1986
+ 3 259.484 98.971 8.472 121.584 +1.714911e+06 ?-? 1.0000
1.1944 1.1915 1.1948 1.1939 1.1827 1.1936 1.1924 1.1980 1.1959
+ 4 315.072 156.019 7.929 115.425 +6.862762e+06 ?-? 1.0000
1.1951 1.1952 1.1949 1.1953 1.1948 1.1951 1.1958 1.1941 1.1912
+ 5 292.346 173.878 8.151 113.497 +1.192233e+06 ?-? 1.0000
1.1987 1.1975 1.1970 1.1913 1.1919 1.2012 1.2065 1.1943 1.1928
+ 6 254.468 150.749 8.521 115.994 +1.179448e+06 T2N-H 1.0000
1.1970 1.1965 1.1942 1.1966 1.1989 1.1927 1.2003 1.1880 1.2002
+ 7 236.655 59.002 8.695 125.899 +4.407306e+06 K3N-H 1.0000
1.1943 1.1941 1.1945 1.1932 1.1969 1.1948 1.1951 1.1945 1.1939
+ 8 192.840 85.845 9.123 123.001 +3.480382e+06 A4N-H 1.0000
1.1951 1.1951 1.1960 1.1962 1.1926 1.1948 1.1908 1.1923 1.1892
+ 9 159.979 105.871 9.444 120.839 +4.306408e+06 V5N-H 1.0000
1.1952 1.1952 1.1951 1.1989 1.1963 1.1957 1.1929 1.1945 1.1898
+ 10 165.200 30.297 9.393 128.998 +3.454030e+06 A6N-H 1.0000
1.1964 1.1966 1.1969 1.1928 1.1954 1.1959 1.1951 1.1968 1.1953
r20506 - /trunk/test_suite/shared_data/peak_lists/seriesTab_multi.ser