Mercurial > repos > computational-metabolomics > dimspy_get_peaklists
view test-data/batch04_QC17_rep01_262.txt @ 1:657c7f8f26b5 draft
"planemo upload for repository https://github.com/computational-metabolomics/dimspy-galaxy commit 680116d0cf6a6d7246cba655452dea43269aeba4"
author | computational-metabolomics |
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date | Tue, 28 Apr 2020 17:30:46 -0400 |
parents | afc9136ab094 |
children |
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mz intensity snr present fraction rsd occurrence purity snr_flag fraction_flag flags 97.00500386290739 24371.84765625 10.213898346288573 1 0.1 nan 1.0 1.0 1 0 0 98.99550184665189 82339.65546875 34.22403960597927 10 1.0 6.928196403714851 10.0 1.0 1 1 1 101.75228905305326 26659.798828125 11.385289945622 1 0.1 nan 1.0 1.0 1 0 0 101.75317073167301 27749.7890625 11.62954604890782 1 0.1 nan 1.0 1.0 1 0 0 101.76000108895448 27966.896484375 12.018095062340132 1 0.1 nan 1.0 1.0 1 0 0 101.76078544905327 27373.521484375 10.900619804017799 1 0.1 nan 1.0 1.0 1 0 0 101.76194298248556 31181.61328125 13.316368606831578 1 0.1 nan 1.0 1.0 1 0 0 101.7624155187057 29687.05078125 11.821908038163564 1 0.1 nan 1.0 1.0 1 0 0 101.76282334264731 33850.91796875 14.18644330696448 1 0.1 nan 1.0 1.0 1 0 0 101.76386265773047 24648.490234375 10.160277225227786 1 0.1 nan 1.0 1.0 1 0 0 101.76963202368513 30046.443359375 12.911729865340364 1 0.1 nan 1.0 1.0 1 0 0 101.77065627514105 29317.15234375 12.084731861236834 1 0.1 nan 1.0 1.0 1 0 0 101.77123019781453 26653.9208984375 11.17983511661892 2 0.2 12.374563947841773 2.0 1.0 1 0 0 101.77192470299032 28194.547526041668 11.673721202431357 3 0.3 12.935731000896125 3.0 1.0 1 0 0 101.77247222965087 34544.1826171875 14.337952765603328 2 0.2 12.954787696619583 2.0 1.0 1 0 0 101.77367951377553 25715.689453125 10.535763483649339 1 0.1 nan 1.0 1.0 1 0 0 101.7739536336187 30085.44921875 12.417921348999618 1 0.1 nan 1.0 1.0 1 0 0 101.77416734192767 26579.9921875 11.044148807442102 2 0.2 5.16123631346911 2.0 1.0 1 0 0 101.77444423078076 29461.850911458332 12.093218869508652 3 0.3 20.528388653009063 3.0 1.0 1 0 0 101.77476570366255 27428.7265625 11.53145776355044 1 0.1 nan 1.0 1.0 1 0 0 101.7755610226972 24917.181640625 10.42063244676082 2 0.2 2.7596547996120058 2.0 1.0 1 0 0 101.77607168450241 29167.180989583332 12.395804185129222 3 0.3 23.48122279670964 3.0 1.0 1 0 0 101.77639330177301 28083.974609375 11.651553286179801 2 0.2 4.853658562113072 2.0 1.0 1 0 0 101.77690507443042 26652.576171875 11.339495716095964 2 0.2 11.70681084154006 2.0 1.0 1 0 0 101.77713853190536 32581.884765625 13.914366249461095 1 0.1 nan 1.0 1.0 1 0 0 101.77743830587724 28769.87890625 12.060338215368423 4 0.4 9.135547035441826 4.0 1.0 1 0 0 101.77796757908791 32452.650390625 13.138204625039084 2 0.2 21.736421166307487 2.0 1.0 1 0 0 101.77848069579964 23612.796875 10.147026420683657 1 0.1 nan 1.0 1.0 1 0 0 101.7789435265002 27877.559895833332 11.60936742965931 3 0.3 10.370494007778346 3.0 1.0 1 0 0 101.7794270214854 34463.37939453125 14.330108420600155 4 0.4 38.369213557409005 4.0 1.0 1 0 0 101.77971711073697 24811.103515625 10.327534132799613 2 0.2 2.227700983632723 2.0 1.0 1 0 0 101.78004128755488 25475.501953125 10.67642432941136 1 0.1 nan 1.0 1.0 1 0 0 101.780514162338 31097.784375 12.930166654569296 5 0.5 20.574784521900973 5.0 1.0 1 1 1 101.78091861449957 39182.81796875 16.350820946923136 5 0.5 24.192248445433215 5.0 1.0 1 1 1 101.78124387467369 38214.717447916664 15.804900396524596 3 0.3 27.977608066636645 3.0 1.0 1 0 0 101.78159062267011 40594.796875 16.76729047850085 5 0.5 21.14399676905738 5.0 1.0 1 1 1 101.78183814692038 30143.6171875 12.43475776862026 2 0.2 18.646449856649852 2.0 1.0 1 0 0 101.78211635966208 36808.7841796875 15.285422143971708 2 0.2 19.47683397554598 2.0 1.0 1 0 0 101.78241431548939 28633.064453125 11.811747640092179 2 0.2 1.145059159122586 2.0 1.0 1 0 0 101.78280859485733 26783.368489583332 11.183922508489971 3 0.3 14.135830199782298 3.0 1.0 1 0 0 101.78316552328657 27275.110026041668 11.332122598474369 3 0.3 11.823473044236584 3.0 1.0 1 0 0 101.78354588053243 29050.9228515625 12.021517835518196 2 0.2 17.6436638920404 2.0 1.0 1 0 0 101.78390544356508 28391.142578125 11.762964772803125 4 0.4 4.401731676535958 4.0 1.0 1 0 0 101.7841491450544 27739.1435546875 11.606814211529208 4 0.4 8.149552216328528 4.0 1.0 1 0 0 101.78443117890701 28911.16162109375 12.093716948631602 4 0.4 17.500744303839074 4.0 1.0 1 0 0 101.78530424934897 24184.279296875 10.114868105618438 2 0.2 2.2588171913780872 2.0 1.0 1 0 0 101.78553606168303 27051.505859375 10.772387493787571 1 0.1 nan 1.0 1.0 1 0 0 101.78578644338397 27879.6318359375 11.799298948216531 2 0.2 21.882502908582858 2.0 1.0 1 0 0 101.78603730290558 27588.710286458332 11.429923073297777 3 0.3 9.469930553306865 3.0 1.0 1 0 0 101.78653923501932 25378.8046875 10.905925420553668 1 0.1 nan 1.0 1.0 1 0 0 101.78678219568093 26657.310546875 11.38422730431401 1 0.1 nan 1.0 1.0 1 0 0 101.78754117651954 29210.240234375 11.63203365561483 1 0.1 nan 1.0 1.0 1 0 0 101.79084333570566 28339.234375 12.00360994000899 2 0.2 4.082106549728015 2.0 1.0 1 0 0 103.03894844996923 27147.4697265625 11.160814324746315 2 0.2 13.967845902735695 2.0 1.0 1 0 0 104.10697223110279 34173.5111328125 14.210797434931749 10 1.0 14.416379402403761 10.0 1.0 1 1 1 106.95056488923676 29902.12109375 12.381413863945 3 0.3 12.542427507823403 3.0 1.0 1 0 0 112.05230011502226 125304.3734375 52.12327111926719 10 1.0 9.303655248549612 10.0 1.0 1 1 1 113.02090450062457 26678.64501953125 11.169856515228199 4 0.4 5.022349072915684 4.0 1.0 1 0 0 114.06618001577837 56829.090625 23.61869318717988 10 1.0 14.043192147150494 10.0 1.0 1 1 1 115.03655404110947 29680.170355902777 12.392709588842358 9 0.9 7.69499083255303 9.0 1.0 1 1 1 116.07059983692884 25672.63525390625 10.539689794581648 4 0.4 0.7776951139667494 4.0 1.0 1 0 0 118.08625389253882 254971.453125 106.03019824093967 10 1.0 5.22873345275066 10.0 1.0 1 1 1 119.01893465031257 28773.407552083332 11.996967200396355 3 0.3 7.205706857849702 3.0 1.0 1 0 0 123.01384564291916 41386.498828125 17.241528115704067 10 1.0 12.836712196217064 10.0 1.0 1 1 1 123.05529437130215 26045.721875 10.920983258722282 5 0.5 9.163727151160234 5.0 1.0 1 1 1 128.01084385720364 40573.8515625 16.845121399253827 10 1.0 11.429270359466408 10.0 1.0 1 1 1 128.9948629722957 53779.0125 22.38271091930887 10 1.0 12.527422340438186 10.0 1.0 1 1 1 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