Author: bugman
Date: Fri Feb 18 14:24:01 2011
New Revision: 12557
URL: http://svn.gna.org/viewcvs/relax?rev=12557&view=rev
Log:
Created the peak height error file errors_R1.txt from testT1.txt.
Added:
1.3/test_suite/shared_data/pdc_files/errors_R1.txt (with props)
Added: 1.3/test_suite/shared_data/pdc_files/errors_R1.txt
URL:
http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/pdc_files/errors_R1.txt?rev=12557&view=auto
==============================================================================
--- 1.3/test_suite/shared_data/pdc_files/errors_R1.txt (added)
+++ 1.3/test_suite/shared_data/pdc_files/errors_R1.txt Fri Feb 18 14:24:01
2011
@@ -1,0 +1,73 @@
+#SECTION: used integral errors
+#Mixing time s: 0.01000000 0.05000000
0.10000000 0.10000000 0.20000000
0.30000000 0.40000000 0.50000000
0.50000000 0.70000000 1.00000000
1.50000000
+#Peak name I0 I1
I2 I3 I4 I5
I6 I7 I8
I9 I10 I11
+ Gln 2 1608301.59447534 1607613.84326396
1608249.33096598 1588840.25616723 1608744.91632413
1624141.35059149 1599708.05488950 1616400.26664149
1614299.97588381 1623059.36429784 1610369.76463726
1619654.26944291
+ Ile 3 1207564.59447534 1206876.84326396
1207512.33096598 1188103.25616723 1208007.91632413
1223404.35059149 1198971.05488950 1215663.26664149
1213562.97588381 1222322.36429784 1209632.76463726
1218917.26944291
+ Phe 4 1734752.59447534 1734064.84326396
1734700.33096598 1715291.25616723 1735195.91632413
1750592.35059149 1726159.05488950 1742851.26664149
1740750.97588381 1749510.36429784 1736820.76463726
1746105.26944291
+ Val 5 1036197.59447534 1035509.84326396
1036145.33096598 1016736.25616723 1036640.91632413
1052037.35059149 1027604.05488950 1044296.26664149
1042195.97588381 1050955.36429784 1038265.76463726
1047550.26944291
+ Lys 6 433733.59447534 433045.84326396
433681.33096598 414272.25616723 434176.91632413
449573.35059149 425140.05488950 441832.26664149
439731.97588381 448491.36429784 435801.76463726
445086.26944291
+ Thr 7 1766198.59447534 1765510.84326396
1766146.33096598 1746737.25616723 1766641.91632413
1782038.35059149 1757605.05488950 1774297.26664149
1772196.97588381 1780956.36429784 1768266.76463726
1777551.26944291
+ Leu 8 1606653.59447534 1605965.84326396
1606601.33096598 1587192.25616723 1607096.91632413
1622493.35059149 1598060.05488950 1614752.26664149
1612651.97588381 1621411.36429784 1608721.76463726
1618006.26944291
+ Thr 9 835081.59447534 834393.84326396
835029.33096598 815620.25616723 835524.91632413
850921.35059149 826488.05488950 843180.26664149
841079.97588381 849839.36429784 837149.76463726
846434.26944291
+ Gly 10 588274.59447534 587586.84326396
588222.33096598 568813.25616723 588717.91632413
604114.35059149 579681.05488950 596373.26664149
594272.97588381 603032.36429784 590342.76463726
599627.26944291
+ Lys 11 1129235.59447534 1128547.84326396
1129183.33096598 1109774.25616723 1129678.91632413
1145075.35059149 1120642.05488950 1137334.26664149
1135233.97588381 1143993.36429784 1131303.76463726
1140588.26944291
+ Thr 12 3053176.59447534 3052488.84326396
3053124.33096598 3033715.25616723 3053619.91632413
3069016.35059149 3044583.05488950 3061275.26664149
3059174.97588381 3067934.36429784 3055244.76463726
3064529.26944291
+ Ile 13 1590277.59447534 1589589.84326396
1590225.33096598 1570816.25616723 1590720.91632413
1606117.35059149 1581684.05488950 1598376.26664149
1596275.97588381 1605035.36429784 1592345.76463726
1601630.26944291
+ Thr 14 1672522.59447534 1671834.84326396
1672470.33096598 1653061.25616723 1672965.91632413
1688362.35059149 1663929.05488950 1680621.26664149
1678520.97588381 1687280.36429784 1674590.76463726
1683875.26944291
+ Leu 15 3824657.59447534 3823969.84326396
3824605.33096598 3805196.25616723 3825100.91632413
3840497.35059149 3816064.05488950 3832756.26664149
3830655.97588381 3839415.36429784 3826725.76463726
3836010.26944291
+ Glu 16 5746972.59447534 5746284.84326396
5746920.33096598 5727511.25616723 5747415.91632413
5762812.35059149 5738379.05488950 5755071.26664149
5752970.97588381 5761730.36429784 5749040.76463726
5758325.26944291
+ Val 17 1895623.59447534 1894935.84326396
1895571.33096598 1876162.25616723 1896066.91632413
1911463.35059149 1887030.05488950 1903722.26664149
1901621.97588381 1910381.36429784 1897691.76463726
1906976.26944291
+ Glu 18 2914578.59447534 2913890.84326396
2914526.33096598 2895117.25616723 2915021.91632413
2930418.35059149 2905985.05488950 2922677.26664149
2920576.97588381 2929336.36429784 2916646.76463726
2925931.26944291
+ Ser 20 1108455.59447534 1107767.84326396
1108403.33096598 1088994.25616723 1108898.91632413
1124295.35059149 1099862.05488950 1116554.26664149
1114453.97588381 1123213.36429784 1110523.76463726
1119808.26944291
+ Asp 21 685366.59447534 684678.84326396
685314.33096598 665905.25616723 685809.91632413
701206.35059149 676773.05488950 693465.26664149
691364.97588381 700124.36429784 687434.76463726
696719.26944291
+ Thr 22 1420143.59447534 1419455.84326396
1420091.33096598 1400682.25616723 1420586.91632413
1435983.35059149 1411550.05488950 1428242.26664149
1426141.97588381 1434901.36429784 1422211.76463726
1431496.26944291
+ Ile 23 2055354.59447534 2054666.84326396
2055302.33096598 2035893.25616723 2055797.91632413
2071194.35059149 2046761.05488950 2063453.26664149
2061352.97588381 2070112.36429784 2057422.76463726
2066707.26944291
+ Asn 25 1368445.59447534 1367757.84326396
1368393.33096598 1348984.25616723 1368888.91632413
1384285.35059149 1359852.05488950 1376544.26664149
1374443.97588381 1383203.36429784 1370513.76463726
1379798.26944291
+ Val 26 5609394.59447534 5608706.84326396
5609342.33096598 5589933.25616723 5609837.91632413
5625234.35059149 5600801.05488950 5617493.26664149
5615392.97588381 5624152.36429784 5611462.76463726
5620747.26944291
+ Lys 27 1504090.59447534 1503402.84326396
1504038.33096598 1484629.25616723 1504533.91632413
1519930.35059149 1495497.05488950 1512189.26664149
1510088.97588381 1518848.36429784 1506158.76463726
1515443.26944291
+ Ala 28 1984806.59447534 1984118.84326396
1984754.33096598 1965345.25616723 1985249.91632413
2000646.35059149 1976213.05488950 1992905.26664149
1990804.97588381 1999564.36429784 1986874.76463726
1996159.26944291
+ Lys 29 1325809.59447534 1325121.84326396
1325757.33096598 1306348.25616723 1326252.91632413
1341649.35059149 1317216.05488950 1333908.26664149
1331807.97588381 1340567.36429784 1327877.76463726
1337162.26944291
+ Thr 30 3682963.59447534 3682275.84326396
3682911.33096598 3663502.25616723 3683406.91632413
3698803.35059149 3674370.05488950 3691062.26664149
3688961.97588381 3697721.36429784 3685031.76463726
3694316.26944291
+ Gln 31 3564536.59447534 3563848.84326396
3564484.33096598 3545075.25616723 3564979.91632413
3580376.35059149 3555943.05488950 3572635.26664149
3570534.97588381 3579294.36429784 3566604.76463726
3575889.26944291
+ Asp 32 1755760.59447534 1755072.84326396
1755708.33096598 1736299.25616723 1756203.91632413
1771600.35059149 1747167.05488950 1763859.26664149
1761758.97588381 1770518.36429784 1757828.76463726
1767113.26944291
+ Lys 33 2073004.59447534 2072316.84326396
2072952.33096598 2053543.25616723 2073447.91632413
2088844.35059149 2064411.05488950 2081103.26664149
2079002.97588381 2087762.36429784 2075072.76463726
2084357.26944291
+ Glu 34 973448.59447534 972760.84326396
973396.33096598 953987.25616723 973891.91632413
989288.35059149 964855.05488950 981547.26664149
979446.97588381 988206.36429784 975516.76463726
984801.26944291
+ Gly 35 1240208.59447534 1239520.84326396
1240156.33096598 1220747.25616723 1240651.91632413
1256048.35059149 1231615.05488950 1248307.26664149
1246206.97588381 1254966.36429784 1242276.76463726
1251561.26944291
+ Ile 36 1641594.59447534 1640906.84326396
1641542.33096598 1622133.25616723 1642037.91632413
1657434.35059149 1633001.05488950 1649693.26664149
1647592.97588381 1656352.36429784 1643662.76463726
1652947.26944291
+ Asp 39 695892.59447534 695204.84326396
695840.33096598 676431.25616723 696335.91632413
711732.35059149 687299.05488950 703991.26664149
701890.97588381 710650.36429784 697960.76463726
707245.26944291
+ Gln 40 1352854.59447534 1352166.84326396
1352802.33096598 1333393.25616723 1353297.91632413
1368694.35059149 1344261.05488950 1360953.26664149
1358852.97588381 1367612.36429784 1354922.76463726
1364207.26944291
+ Gln 41 1201501.59447534 1200813.84326396
1201449.33096598 1182040.25616723 1201944.91632413
1217341.35059149 1192908.05488950 1209600.26664149
1207499.97588381 1216259.36429784 1203569.76463726
1212854.26944291
+ Arg 42 5832818.59447534 5832130.84326396
5832766.33096598 5813357.25616723 5833261.91632413
5848658.35059149 5824225.05488950 5840917.26664149
5838816.97588381 5847576.36429784 5834886.76463726
5844171.26944291
+ Leu 43 2200392.59447534 2199704.84326396
2200340.33096598 2180931.25616723 2200835.91632413
2216232.35059149 2191799.05488950 2208491.26664149
2206390.97588381 2215150.36429784 2202460.76463726
2211745.26944291
+ Ile 44 1261210.59447534 1260522.84326396
1261158.33096598 1241749.25616723 1261653.91632413
1277050.35059149 1252617.05488950 1269309.26664149
1267208.97588381 1275968.36429784 1263278.76463726
1272563.26944291
+ Phe 45 1340131.59447534 1339443.84326396
1340079.33096598 1320670.25616723 1340574.91632413
1355971.35059149 1331538.05488950 1348230.26664149
1346129.97588381 1354889.36429784 1342199.76463726
1351484.26944291
+ Ala 46 683046.59447534 682358.84326396
682994.33096598 663585.25616723 683489.91632413
698886.35059149 674453.05488950 691145.26664149
689044.97588381 697804.36429784 685114.76463726
694399.26944291
+ Gly 47 1240282.59447534 1239594.84326396
1240230.33096598 1220821.25616723 1240725.91632413
1256122.35059149 1231689.05488950 1248381.26664149
1246280.97588381 1255040.36429784 1242350.76463726
1251635.26944291
+ Lys 48 4334363.59447534 4333675.84326396
4334311.33096598 4314902.25616723 4334806.91632413
4350203.35059149 4325770.05488950 4342462.26664149
4340361.97588381 4349121.36429784 4336431.76463726
4345716.26944291
+ Gln 49 1259901.59447534 1259213.84326396
1259849.33096598 1240440.25616723 1260344.91632413
1275741.35059149 1251308.05488950 1268000.26664149
1265899.97588381 1274659.36429784 1261969.76463726
1271254.26944291
+ Leu 50 2101483.59447534 2100795.84326396
2101431.33096598 2082022.25616723 2101926.91632413
2117323.35059149 2092890.05488950 2109582.26664149
2107481.97588381 2116241.36429784 2103551.76463726
2112836.26944291
+ Glu 51 1803723.59447534 1803035.84326396
1803671.33096598 1784262.25616723 1804166.91632413
1819563.35059149 1795130.05488950 1811822.26664149
1809721.97588381 1818481.36429784 1805791.76463726
1815076.26944291
+ Asp 52 2204322.59447534 2203634.84326396
2204270.33096598 2184861.25616723 2204765.91632413
2220162.35059149 2195729.05488950 2212421.26664149
2210320.97588381 2219080.36429784 2206390.76463726
2215675.26944291
+ Arg 54 651098.59447534 650410.84326396
651046.33096598 631637.25616723 651541.91632413
666938.35059149 642505.05488950 659197.26664149
657096.97588381 665856.36429784 653166.76463726
662451.26944291
+ Thr 55 1251252.59447534 1250564.84326396
1251200.33096598 1231791.25616723 1251695.91632413
1267092.35059149 1242659.05488950 1259351.26664149
1257250.97588381 1266010.36429784 1253320.76463726
1262605.26944291
+ Leu 56 813335.59447534 812647.84326396
813283.33096598 793874.25616723 813778.91632413
829175.35059149 804742.05488950 821434.26664149
819333.97588381 828093.36429784 815403.76463726
824688.26944291
+ Ser 57 935176.59447534 934488.84326396
935124.33096598 915715.25616723 935619.91632413
951016.35059149 926583.05488950 943275.26664149
941174.97588381 949934.36429784 937244.76463726
946529.26944291
+ Asp 58 1418505.59447534 1417817.84326396
1418453.33096598 1399044.25616723 1418948.91632413
1434345.35059149 1409912.05488950 1426604.26664149
1424503.97588381 1433263.36429784 1420573.76463726
1429858.26944291
+ Tyr 59 716485.59447534 715797.84326396
716433.33096598 697024.25616723 716928.91632413
732325.35059149 707892.05488950 724584.26664149
722483.97588381 731243.36429784 718553.76463726
727838.26944291
+ Asn 60 988517.59447534 987829.84326396
988465.33096598 969056.25616723 988960.91632413
1004357.35059149 979924.05488950 996616.26664149
994515.97588381 1003275.36429784 990585.76463726
999870.26944291
+ Ile 61 1273854.59447534 1273166.84326396
1273802.33096598 1254393.25616723 1274297.91632413
1289694.35059149 1265261.05488950 1281953.26664149
1279852.97588381 1288612.36429784 1275922.76463726
1285207.26944291
+ Gln 62 1548162.59447534 1547474.84326396
1548110.33096598 1528701.25616723 1548605.91632413
1564002.35059149 1539569.05488950 1556261.26664149
1554160.97588381 1562920.36429784 1550230.76463726
1559515.26944291
+ Lys 63 1830130.59447534 1829442.84326396
1830078.33096598 1810669.25616723 1830573.91632413
1845970.35059149 1821537.05488950 1838229.26664149
1836128.97588381 1844888.36429784 1832198.76463726
1841483.26944291
+ Glu 64 1063413.59447534 1062725.84326396
1063361.33096598 1043952.25616723 1063856.91632413
1079253.35059149 1054820.05488950 1071512.26664149
1069411.97588381 1078171.36429784 1065481.76463726
1074766.26944291
+ Ser 65 556843.59447534 556155.84326396
556791.33096598 537382.25616723 557286.91632413
572683.35059149 548250.05488950 564942.26664149
562841.97588381 571601.36429784 558911.76463726
568196.26944291
+ Thr 66 673180.59447534 672492.84326396
673128.33096598 653719.25616723 673623.91632413
689020.35059149 664587.05488950 681279.26664149
679178.97588381 687938.36429784 675248.76463726
684533.26944291
+ Leu 67 1889886.59447534 1889198.84326396
1889834.33096598 1870425.25616723 1890329.91632413
1905726.35059149 1881293.05488950 1897985.26664149
1895884.97588381 1904644.36429784 1891954.76463726
1901239.26944291
+ His 68 427689.59447534 427001.84326396
427637.33096598 408228.25616723 428132.91632413
443529.35059149 419096.05488950 435788.26664149
433687.97588381 442447.36429784 429757.76463726
439042.26944291
+ Leu 69 2044836.59447534 2044148.84326396
2044784.33096598 2025375.25616723 2045279.91632413
2060676.35059149 2036243.05488950 2052935.26664149
2050834.97588381 2059594.36429784 2046904.76463726
2056189.26944291
+ Val 70 1247957.59447534 1247269.84326396
1247905.33096598 1228496.25616723 1248400.91632413
1263797.35059149 1239364.05488950 1256056.26664149
1253955.97588381 1262715.36429784 1250025.76463726
1259310.26944291
+ Leu 71 613186.59447534 612498.84326396
613134.33096598 593725.25616723 613629.91632413
629026.35059149 604593.05488950 621285.26664149
619184.97588381 627944.36429784 615254.76463726
624539.26944291
+ Arg 72 1857788.59447534 1857100.84326396
1857736.33096598 1838327.25616723 1858231.91632413
1873628.35059149 1849195.05488950 1865887.26664149
1863786.97588381 1872546.36429784 1859856.76463726
1869141.26944291
+ Leu 73 2298012.59447534 2297324.84326396
2297960.33096598 2278551.25616723 2298455.91632413
2313852.35059149 2289419.05488950 2306111.26664149
2304010.97588381 2312770.36429784 2300080.76463726
2309365.26944291
+ Arg 74 1940356.59447534 1939668.84326396
1940304.33096598 1920895.25616723 1940799.91632413
1956196.35059149 1931763.05488950 1948455.26664149
1946354.97588381 1955114.36429784 1942424.76463726
1951709.26944291
+ Gly 75 1589236.59447534 1588548.84326396
1589184.33096598 1569775.25616723 1589679.91632413
1605076.35059149 1580643.05488950 1597335.26664149
1595234.97588381 1603994.36429784 1591304.76463726
1600589.26944291
+ Gly 76 920699.59447534 920011.84326396
920647.33096598 901238.25616723 921142.91632413
936539.35059149 912106.05488950 928798.26664149
926697.97588381 935457.36429784 922767.76463726
932052.26944291
Propchange: 1.3/test_suite/shared_data/pdc_files/errors_R1.txt
------------------------------------------------------------------------------
svn:eol-style = native
r12557 - /1.3/test_suite/shared_data/pdc_files/errors_R1.txt