comparison test-data/batch04_QC17_rep02_263.txt @ 0:33b65dacd377 draft

"planemo upload for repository https://github.com/computational-metabolomics/dimspy-galaxy commit 6321871098b2c4bc9e321d20b7e66fff3d641839"
author computational-metabolomics
date Sat, 11 Apr 2020 16:51:19 -0400
parents
children c72868b80c29
comparison
equal deleted inserted replaced
-1:000000000000 0:33b65dacd377
1 mz intensity snr present fraction rsd occurrence purity snr_flag fraction_flag flags
2 98.9955019004 84451.2265625 31.7440778089 10 1.0 7.77367705111 10.0 1.0 1 1 1
3 101.761245271 32550.375 11.7929465044 1 0.1 nan 1.0 1.0 1 0 0
4 101.762109411 35030.5703125 12.6915171243 1 0.1 nan 1.0 1.0 1 0 0
5 101.76262088 35174.5234375 13.418830959 1 0.1 nan 1.0 1.0 1 0 0
6 101.763132954 26464.4316406 10.0959927785 1 0.1 nan 1.0 1.0 1 0 0
7 101.763354418 28354.5146484 10.7086199539 2 0.2 4.57943273784 2.0 1.0 1 0 0
8 101.764453602 30835.7578125 11.6280785711 2 0.2 13.9128862206 2.0 1.0 1 0 0
9 101.7651537 27039.2695312 10.1936221136 1 0.1 nan 1.0 1.0 1 0 0
10 101.771710654 31634.0732422 11.6823623565 2 0.2 19.4181918985 2.0 1.0 1 0 0
11 101.772204612 29348.18125 11.0363579242 5 0.5 8.49275304413 5.0 1.0 1 1 1
12 101.772782957 29805.6152344 11.2285206144 2 0.2 3.11583437987 2.0 1.0 1 0 0
13 101.773211058 32438.3046875 11.7756102024 2 0.2 18.9035505882 2.0 1.0 1 0 0
14 101.774160788 33584.6757812 12.6305511407 4 0.4 28.6332913038 4.0 1.0 1 0 0
15 101.774601733 31854.6848958 11.9396540804 3 0.3 11.3977479521 3.0 1.0 1 0 0
16 101.774886361 27928.8457031 10.5289863263 1 0.1 nan 1.0 1.0 1 0 0
17 101.77534776 28452.9785156 10.7701086914 1 0.1 nan 1.0 1.0 1 0 0
18 101.775569642 44103.8515625 16.3666890296 1 0.1 nan 1.0 1.0 1 0 0
19 101.776203278 29334.0644531 11.2642139913 2 0.2 4.51023573503 2.0 1.0 1 0 0
20 101.776462277 28595.7910156 10.8241665169 1 0.1 nan 1.0 1.0 1 0 0
21 101.776797216 27960.3776042 10.591041447 3 0.3 3.49564290589 3.0 1.0 1 0 0
22 101.777401466 27360.0703125 10.3145618429 1 0.1 nan 1.0 1.0 1 0 0
23 101.777789955 33314.375 12.6454242076 2 0.2 9.04850068751 2.0 1.0 1 0 0
24 101.778108289 31527.1692708 11.700624089 3 0.3 10.4051336347 3.0 1.0 1 0 0
25 101.778498576 31337.5234375 11.7630284794 2 0.2 9.7160562875 3.0 0.5 1 0 0
26 101.778821835 28602.9160156 10.6143798145 1 0.1 nan 1.0 1.0 1 0 0
27 101.779113798 27481.7773438 10.4841029412 1 0.1 nan 1.0 1.0 1 0 0
28 101.779616687 31644.8125 11.9672764207 2 0.2 9.08421199185 2.0 1.0 1 0 0
29 101.78012274 31657.746582 11.6955277262 4 0.4 12.3275680339 4.0 1.0 1 0 0
30 101.78036894 35063.9345703 13.3989264485 2 0.2 14.9162035085 2.0 1.0 1 0 0
31 101.780603216 39432.7519531 14.4487910205 2 0.2 18.0989507839 2.0 1.0 1 0 0
32 101.780950357 30655.5917969 11.7665710618 1 0.1 nan 1.0 1.0 1 0 0
33 101.781223124 32459.6645508 12.2859713321 4 0.4 13.7445471032 4.0 1.0 1 0 0
34 101.78145739 39429.2753906 14.6538488163 5 0.5 18.9477858001 5.0 1.0 1 1 1
35 101.781813314 42852.5403646 16.0113159229 6 0.6 22.2676926764 6.0 1.0 1 1 1
36 101.782168131 39139.2646484 14.8314227801 4 0.4 21.7636584822 4.0 1.0 1 0 0
37 101.782467224 37896.9567057 14.3413984371 6 0.6 19.7000657986 6.0 1.0 1 1 1
38 101.782725561 42090.5410156 15.562375607 2 0.2 29.1779842887 2.0 1.0 1 0 0
39 101.782955956 32858.3325195 12.3017226935 4 0.4 19.8198479159 4.0 1.0 1 0 0
40 101.783291974 31514.2480469 12.0264628523 2 0.2 0.567130026237 2.0 1.0 1 0 0
41 101.783843492 40019.9663086 15.2751560113 4 0.4 39.5606314199 4.0 1.0 1 0 0
42 101.784269638 32181.0286458 12.020740205 3 0.3 14.1201888078 3.0 1.0 1 0 0
43 101.78457014 33495.125 12.627436052 1 0.1 nan 1.0 1.0 1 0 0
44 101.784935333 29937.0722656 11.2726505855 5 0.5 15.8922733176 5.0 1.0 1 1 1
45 101.785253204 29677.3105469 11.013081528 1 0.1 nan 1.0 1.0 1 0 0
46 101.785870948 29142.7080078 11.1560273863 2 0.2 5.04318288896 2.0 1.0 1 0 0
47 101.786439724 31269.7294922 11.6942397129 2 0.2 3.07955196643 2.0 1.0 1 0 0
48 101.787378671 27573.0634766 10.5227174727 2 0.2 0.248128846262 2.0 1.0 1 0 0
49 101.788201622 27024.7001953 10.2294724011 1 0.1 nan 2.0 0.0 1 0 0
50 101.78857405 26586.7402344 10.2700249585 1 0.1 nan 1.0 1.0 1 0 0
51 101.790917832 28723.8779297 10.8832981272 2 0.2 2.31937603418 2.0 1.0 1 0 0
52 101.7919515 30445.0292969 11.5241458626 1 0.1 nan 1.0 1.0 1 0 0
53 103.038944067 35208.5872396 13.2431316327 3 0.3 10.2019852039 3.0 1.0 1 0 0
54 104.106977796 31143.5230035 11.7164106858 9 0.9 12.3991598947 9.0 1.0 1 1 1
55 112.052301717 153719.28125 57.7564689829 10 1.0 6.67470171676 10.0 1.0 1 1 1
56 113.020908516 28645.1083984 11.0004142593 2 0.2 8.0214985807 2.0 1.0 1 0 0
57 114.066180002 66439.5613281 24.9706853163 10 1.0 7.86790569849 10.0 1.0 1 1 1
58 115.036558808 35491.1291016 13.3299448805 10 1.0 11.9701202132 10.0 1.0 1 1 1
59 116.07060242 29972.5449219 11.2210950802 5 0.5 6.72227972428 5.0 1.0 1 1 1
60 118.085687934 28924.7222656 10.8551646426 5 0.5 4.78631928298 5.0 1.0 1 1 1
61 118.086252154 334143.975 125.486520294 10 1.0 5.20664687123 10.0 1.0 1 1 1
62 118.086653858 27912.5683594 10.3762819709 1 0.1 nan 1.0 1.0 1 0 0
63 123.013841605 31632.4296875 11.8556645005 9 0.9 8.91490804416 9.0 1.0 1 1 1
64 123.055287124 32552.2897135 12.1910756489 9 0.9 10.4554202922 9.0 1.0 1 1 1
65 126.021930562 30321.7949219 11.5675494837 1 0.1 nan 1.0 1.0 1 0 0
66 128.010845095 48139.7953125 18.0868754199 10 1.0 15.0901614638 10.0 1.0 1 1 1
67 128.994858964 45973.4792969 17.2568922967 10 1.0 14.6812413554 10.0 1.0 1 1 1
68 130.049198924 27880.6601562 10.7698451612 1 0.1 nan 1.0 1.0 1 0 0
69 130.049880906 119751.939062 45.0053779531 10 1.0 13.5955775973 10.0 1.0 1 1 1
70 131.009835312 32898.309375 12.3675147079 10 1.0 9.2134570132 10.0 1.0 1 1 1
71 131.010514714 137421.994531 51.6972877465 10 1.0 9.48388846128 10.0 1.0 1 1 1
72 131.018939825 48886.0308594 18.3871615113 10 1.0 15.6143661875 10.0 1.0 1 1 1
73 132.074582968 29099.0058594 10.8655604381 3 0.3 4.73245654073 3.0 1.0 1 0 0
74 132.075000576 61245.1585937 23.0062885715 10 1.0 6.6190994797 10.0 1.0 1 1 1
75 132.075552632 329270.725 123.677631198 10 1.0 4.13999125262 10.0 1.0 1 1 1
76 132.076095384 1605462.1125 603.219672932 10 1.0 4.17826396596 10.0 1.0 1 1 1
77 132.076678619 15995033.0 6010.26097502 10 1.0 1.86046166012 10.0 1.0 1 1 1
78 132.077213366 1798429.0375 675.742468126 10 1.0 2.11623486529 10.0 1.0 1 1 1
79 132.078042697 38095.5888672 14.3236398431 9 0.9 13.7215663493 11.0 0.777777777778 1 1 1
80 132.10123499 70287.8515625 26.4087193991 10 1.0 9.6136993272 10.0 1.0 1 1 1
81 132.101928966 260195.334375 97.7016537297 10 1.0 6.46474401224 10.0 1.0 1 1 1
82 133.034576799 31180.1796875 11.2965270309 1 0.1 nan 1.0 1.0 1 0 0
83 133.073107006 28835.0175781 10.7733305466 7 0.7 9.41734387681 7.0 1.0 1 1 1
84 133.073804674 106261.24375 39.9022755874 10 1.0 7.60604139854 10.0 1.0 1 1 1
85 133.078933221 35714.8583984 13.4261145427 10 1.0 4.65812935628 10.0 1.0 1 1 1
86 133.079441207 112994.835156 42.4655429376 10 1.0 10.7081932136 10.0 1.0 1 1 1
87 133.080130758 430497.084375 161.86951968 10 1.0 7.73422684669 10.0 1.0 1 1 1
88 133.080636079 36245.6044922 13.6794717511 8 0.8 8.87599158956 8.0 1.0 1 1 1
89 134.04481226 29402.8710938 11.2826850829 2 0.2 9.50433295214 2.0 1.0 1 0 0
90 134.081017792 47303.3210937 17.7838811166 10 1.0 11.752338207 10.0 1.0 1 1 1
91 134.996482207 35648.171875 12.915273139 1 0.1 nan 1.0 1.0 1 0 0
92 135.002882094 72297.2222656 27.1813251072 10 1.0 7.33801015046 10.0 1.0 1 1 1
93 136.046911726 32737.8367188 12.3155990979 10 1.0 7.26785250343 10.0 1.0 1 1 1
94 136.047434121 80373.94375 30.1919796747 10 1.0 5.57807557823 10.0 1.0 1 1 1
95 136.048146965 528813.003125 198.730814907 10 1.0 4.64213258647 10.0 1.0 1 1 1
96 136.048699837 43289.5867187 16.2656623797 10 1.0 8.03921067784 10.0 1.0 1 1 1
97 136.06178491 57162.1019531 21.4973296392 10 1.0 6.37414392129 10.0 1.0 1 1 1
98 136.939346613 28702.4882812 10.8206443566 1 0.1 nan 1.0 1.0 1 0 0
99 136.940066868 134330.621875 50.4635338737 10 1.0 7.85754232268 10.0 1.0 1 1 1
100 137.029503565 31457.2578125 11.6726206949 5 0.5 17.1475506102 5.0 1.0 1 1 1
101 137.045064148 43289.5714844 16.2535788627 10 1.0 11.3374679409 10.0 1.0 1 1 1
102 137.04579769 282509.390625 106.128330796 10 1.0 5.29992043812 10.0 1.0 1 1 1
103 138.052577764 28766.0800781 10.6618291131 2 0.2 3.97869939654 2.0 1.0 1 0 0
104 138.964126152 27634.5097656 10.0576952673 1 0.1 nan 1.0 1.0 1 0 0
105 139.015612062 87313.8757812 32.7984374302 10 1.0 11.0596177273 10.0 1.0 1 1 1
106 140.066929815 65386.7152344 24.5656946033 10 1.0 6.34385277641 10.0 1.0 1 1 1
107 140.067486797 195610.175 73.5008310132 10 1.0 5.67143660289 10.0 1.0 1 1 1
108 140.068180233 1325051.425 497.906467677 10 1.0 4.48965340931 10.0 1.0 1 1 1
109 140.068755299 103401.79375 38.8692908198 10 1.0 7.67971252743 10.0 1.0 1 1 1
110 140.994874703 28897.5014648 10.8105499338 4 0.4 8.38292066836 4.0 1.0 1 0 0
111 141.015857951 116313.95625 43.7136731655 10 1.0 4.92540087208 10.0 1.0 1 1 1
112 141.071582519 53365.9246094 20.0579778211 10 1.0 10.1623522933 10.0 1.0 1 1 1
113 142.948086895 30537.1372768 11.3650741642 7 0.7 7.39680779732 7.0 1.0 1 1 1
114 143.010512781 28524.25 10.7426156377 3 0.3 6.70992822436 3.0 1.0 1 0 0
115 144.101930513 62236.0273438 23.3975891007 10 1.0 9.30944287495 10.0 1.0 1 1 1
116 146.116772096 60405.5019531 22.6966592069 10 1.0 6.37418314366 10.0 1.0 1 1 1
117 146.117588135 350503.471875 131.689159277 10 1.0 7.60649206548 10.0 1.0 1 1 1
118 146.165211819 33865.3450521 12.7010102746 9 0.9 13.8576467061 9.0 1.0 1 1 1
119 147.075034925 99935.4390625 37.542431402 10 1.0 2.83465000643 10.0 1.0 1 1 1
120 147.075632458 371464.078125 139.549713228 10 1.0 3.41217590523 10.0 1.0 1 1 1
121 147.076385671 2669345.575 1002.79094284 10 1.0 3.64086524496 10.0 1.0 1 1 1
122 147.076988068 206060.190625 77.3988051989 10 1.0 4.94636670784 10.0 1.0 1 1 1
123 147.112838715 63052.0660156 23.6952658792 10 1.0 8.31738903991 10.0 1.0 1 1 1
124 147.120940479 27194.938151 10.4128042004 3 0.3 2.56018448355 3.0 1.0 1 0 0
125 148.002473849 40227.3984375 15.1222487625 10 1.0 4.65354391424 10.0 1.0 1 1 1
126 148.003083275 109340.288281 41.0979342906 10 1.0 6.21276472464 10.0 1.0 1 1 1
127 148.003901609 673814.23125 253.114575989 10 1.0 2.76632366923 10.0 1.0 1 1 1
128 148.004520598 48741.3707031 18.3051145819 10 1.0 5.8323752691 10.0 1.0 1 1 1
129 148.059019495 43608.8523437 16.3802833681 10 1.0 3.80131524852 10.0 1.0 1 1 1
130 148.059639238 116815.025 43.8773169886 10 1.0 4.67877660987 10.0 1.0 1 1 1
131 148.060456673 729310.50625 273.832427847 10 1.0 5.4013612774 10.0 1.0 1 1 1
132 148.061109766 52280.1417969 19.6287168306 10 1.0 7.60232197538 10.0 1.0 1 1 1
133 148.079817075 94883.7046875 35.630393982 10 1.0 10.4647663541 10.0 1.0 1 1 1
134 149.063820448 31918.0831473 11.9476078307 7 0.7 13.9847067228 7.0 1.0 1 1 1
135 149.999722024 30384.3857422 11.1535802152 2 0.2 1.8665043408 2.0 1.0 1 0 0
136 150.058361382 30533.1257813 11.419947661 5 0.5 8.43263106287 5.0 1.0 1 1 1
137 150.975951451 29540.439209 11.025090183 8 0.8 6.56541196949 8.0 1.0 1 1 1
138 150.976840578 157328.739844 59.1108221807 10 1.0 7.86845032023 10.0 1.0 1 1 1
139 151.047842477 27289.015625 10.5413025099 1 0.1 nan 1.0 1.0 1 0 0
140 152.02124433 26909.984375 10.186049817 1 0.1 nan 1.0 1.0 1 0 0
141 152.022108414 111681.925781 42.0032070331 10 1.0 15.377524707 10.0 1.0 1 1 1
142 156.040549046 27311.9607599 10.9576614094 11 1.0 6.98673991932 11.0 1.0 1 1 1
143 156.041293069 94128.381392 37.7792353127 11 1.0 5.86388834531 11.0 1.0 1 1 1
144 156.042083227 767776.738636 308.042258211 11 1.0 3.9676251837 11.0 1.0 1 1 1
145 156.076744228 37990.574929 15.2336134332 11 1.0 16.7384185701 11.0 1.0 1 1 1
146 156.989758174 47235.7528409 18.9606227462 11 1.0 8.81955964835 11.0 1.0 1 1 1
147 157.045487847 40516.0596591 16.2636675637 11 1.0 8.15365471966 11.0 1.0 1 1 1
148 158.040243474 56301.5014205 22.5859840025 11 1.0 8.70156290585 11.0 1.0 1 1 1
149 158.921989837 28792.6624349 11.546494524 6 0.545454545455 10.9652353858 6.0 1.0 1 1 1
150 159.013834638 26923.9191406 10.9157909412 5 0.454545454545 7.14043347182 5.0 1.0 1 0 0
151 159.027720783 29607.499566 11.9369117919 9 0.818181818182 12.7951036928 9.0 1.0 1 1 1
152 160.133193625 84523.859375 33.8842999355 11 1.0 9.78229712746 11.0 1.0 1 1 1
153 161.128428632 43478.4328835 17.4460537055 11 1.0 7.90859345692 11.0 1.0 1 1 1
154 162.110691093 74545.0646307 29.9171413077 11 1.0 3.38582063078 11.0 1.0 1 1 1
155 162.111673334 468447.84375 187.340157482 3 0.272727272727 2.29513816613 3.0 1.0 1 0 0
156 162.112347557 3694746.72727 1483.25192238 11 1.0 2.4249936868 11.0 1.0 1 1 1
157 162.113086241 319231.803977 128.17297944 11 1.0 2.63101813656 11.0 1.0 1 1 1
158 163.04512347 26977.8894531 10.735347508 5 0.454545454545 4.53826853585 5.0 1.0 1 0 0
159 163.114864834 27190.895752 10.8868509861 8 0.727272727273 8.10595673897 8.0 1.0 1 1 1
160 163.115813581 214849.02983 86.1972646904 11 1.0 6.73959343438 11.0 1.0 1 1 1
161 163.976867643 59627.850142 23.9412256181 11 1.0 7.58162176901 11.0 1.0 1 1 1
162 163.977787101 540554.900568 216.953908544 11 1.0 4.86384115523 11.0 1.0 1 1 1
163 165.973612436 26817.0996094 10.689085603 3 0.272727272727 6.35895948057 3.0 1.0 1 0 0
164 165.975932742 38753.2013494 15.5669189396 11 1.0 6.8772215161 11.0 1.0 1 1 1
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166 166.950728497 100808.46733 40.4596822037 11 1.0 7.61511149055 11.0 1.0 1 1 1
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169 169.058361815 86678.1946023 34.7867580177 11 1.0 7.4452168704 11.0 1.0 1 1 1
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172 170.042378366 26467.6945312 10.6116150046 5 0.454545454545 5.55916882015 5.0 1.0 1 0 0
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175 172.984684931 33290.6507457 13.3533545658 11 1.0 11.8678900287 11.0 1.0 1 1 1
176 173.080837965 79431.6285511 31.8792191156 11 1.0 7.37056661376 11.0 1.0 1 1 1
177 174.895942921 46625.7120028 18.7087697482 11 1.0 8.81002393616 11.0 1.0 1 1 1
178 175.00167436 143929.236506 57.8257254282 11 1.0 6.082606609 11.0 1.0 1 1 1
179 175.118959446 128894.384943 51.7741395235 11 1.0 3.81788196753 11.0 1.0 1 1 1
180 176.102980115 90002.8458807 36.1020011298 11 1.0 6.24949556849 11.0 1.0 1 1 1
181 177.134609682 41545.7482244 16.641950243 11 1.0 18.4672069068 11.0 1.0 1 1 1
182 179.128464635 43402.8391335 17.4343459446 11 1.0 13.0109202983 11.0 1.0 1 1 1
183 184.073311548 26612.2109375 10.7940274765 1 0.0909090909091 nan 1.0 1.0 1 0 0
184 187.125925624 49756.9350142 20.0055293847 11 1.0 17.3900363879 11.0 1.0 1 1 1
185 189.159797728 25400.7753906 10.1104048425 1 0.0909090909091 nan 1.0 1.0 1 0 0
186 191.040120325 46908.0870028 18.8701791286 11 1.0 28.806392333 11.0 1.0 1 1 1
187 192.014618393 27557.5244141 11.2809102591 2 0.181818181818 14.518788586 2.0 1.0 1 0 0
188 193.001974789 29100.9439174 11.6927626153 7 0.636363636364 6.26860622356 7.0 1.0 1 1 1
189 194.945672893 26739.6020508 10.8513826417 4 0.363636363636 11.6809833056 4.0 1.0 1 0 0
190 198.08489673 25738.8802083 10.4005869497 3 0.272727272727 5.55237756585 3.0 1.0 1 0 0
191 198.097208778 28411.5722656 11.2330658861 3 0.272727272727 11.0627567753 3.0 1.0 1 0 0
192 200.067018748 71118.8799716 28.5355088724 11 1.0 7.3321050697 11.0 1.0 1 1 1
193 200.068322492 446490.954545 179.146733777 11 1.0 7.80282685067 11.0 1.0 1 1 1
194 201.071718915 34718.6780895 13.9174278762 11 1.0 11.0624980136 11.0 1.0 1 1 1
195 201.933725621 145635.56392 58.4529062241 11 1.0 6.26538979395 11.0 1.0 1 1 1
196 202.06649887 32928.6360085 13.2224201395 11 1.0 7.65213360722 11.0 1.0 1 1 1
197 202.180181715 65537.0308949 26.3122443961 11 1.0 6.49640876977 11.0 1.0 1 1 1
198 203.038646686 27478.0705295 11.028143105 9 0.818181818182 7.31683462347 9.0 1.0 1 1 1
199 203.040075042 185696.363636 74.5160595951 11 1.0 5.20972992104 11.0 1.0 1 1 1
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