Mercurial > repos > computational-metabolomics > dimspy_replicate_filter

comparison test-data/batch04_QC18_rep01_280.txt @ 1:0cdf340364ed draft

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"planemo upload for repository https://github.com/computational-metabolomics/dimspy-galaxy commit 680116d0cf6a6d7246cba655452dea43269aeba4"
author computational-metabolomics
date Tue, 28 Apr 2020 17:43:04 -0400
parents cb2acfaec200
children
comparison
equal deleted inserted replaced
0:cb2acfaec200 1:0cdf340364ed
1 mz intensity snr present fraction rsd occurrence purity snr_flag fraction_flag rsd_flag flags 1 mz intensity snr present fraction rsd occurrence purity snr_flag fraction_flag rsd_flag flags
2 98.9954996926 80208.3953125 30.813462032 10 1.0 13.1883919759 10.0 1.0 1 1 1 1 2 98.99549969263934 80208.3953125 30.81450013159012 10 1.0 13.188391975854637 10.0 1.0 1 1 1 1
3 101.759610091 26695.9101562 10.1854822123 1 0.1 nan 1.0 1.0 1 0 0 0 3 101.75961009116513 26695.91015625 10.185482212319478 1 0.1 nan 1.0 1.0 1 0 0 0
4 101.760365942 26872.4453125 10.4309947507 1 0.1 nan 1.0 1.0 1 0 0 0 4 101.76036594196516 26872.4453125 10.430994750743473 1 0.1 nan 1.0 1.0 1 0 0 0
5 101.762686038 27960.1679688 10.5797635172 2 0.2 1.58269631786 2.0 1.0 1 0 1 0 5 101.76268603768057 27960.16796875 10.57976351717732 2 0.2 1.5826963178600748 2.0 1.0 1 0 1 0
6 101.763597815 25178.9960938 10.045997821 1 0.1 nan 1.0 1.0 1 0 0 0 6 101.76359781458609 25178.99609375 10.045997820982565 1 0.1 nan 1.0 1.0 1 0 0 0
7 101.764306425 30354.375 10.7879123064 1 0.1 nan 1.0 1.0 1 0 0 0 7 101.76430642519519 30354.375 10.788520297429091 1 0.1 nan 1.0 1.0 1 0 0 0
8 101.766635331 26666.5117188 10.639491647 1 0.1 nan 1.0 1.0 1 0 0 0 8 101.76663533109402 26666.51171875 10.639491647018657 1 0.1 nan 1.0 1.0 1 0 0 0
9 101.769521884 29821.4394531 11.1879744811 1 0.1 nan 1.0 1.0 1 0 0 0 9 101.76952188448408 29821.439453125 11.187974481053914 1 0.1 nan 1.0 1.0 1 0 0 0
10 101.772366701 25563.8984375 10.1519753986 1 0.1 nan 1.0 1.0 1 0 0 0 10 101.77236670113724 25563.8984375 10.152215073940672 1 0.1 nan 1.0 1.0 1 0 0 0
11 101.773920395 28159.5273438 10.6573236318 2 0.2 4.93272189105 2.0 1.0 1 0 1 0 11 101.77392039491835 28159.52734375 10.657323631754643 2 0.2 4.9327218910484 2.0 1.0 1 0 1 0
12 101.774461656 39659.5976562 15.3945444919 1 0.1 nan 1.0 1.0 1 0 0 0 12 101.77446165630356 39659.59765625 15.394544491881804 1 0.1 nan 1.0 1.0 1 0 0 0
13 101.774756214 27996.7070312 11.4500128305 1 0.1 nan 1.0 1.0 1 0 0 0 13 101.77475621398393 27996.70703125 11.45001283045921 1 0.1 nan 1.0 1.0 1 0 0 0
14 101.775223997 29176.7802734 11.2965104593 2 0.2 4.86114296476 2.0 1.0 1 0 1 0 14 101.77522399718247 29176.7802734375 11.296709224147483 2 0.2 4.86114296476337 2.0 1.0 1 0 1 0
15 101.775895949 28494.4648438 10.6053604475 1 0.1 nan 1.0 1.0 1 0 0 0 15 101.77589594870153 28494.46484375 10.605560895592316 1 0.1 nan 1.0 1.0 1 0 0 0
16 101.776230073 35452.1953125 13.7415439949 2 0.2 6.33353983854 2.0 1.0 1 0 1 0 16 101.77623007348964 35452.1953125 13.741543994874744 2 0.2 6.333539838544479 2.0 1.0 1 0 1 0
17 101.776634346 31432.4414062 11.990010385 2 0.2 4.63037911522 2.0 1.0 1 0 1 0 17 101.77663434599373 31432.44140625 11.990010384968196 2 0.2 4.63037911522173 2.0 1.0 1 0 1 0
18 101.777200694 28648.8056641 11.1574371861 2 0.2 8.6734633642 2.0 1.0 1 0 1 0 18 101.77720069388388 28648.8056640625 11.157544133076307 2 0.2 8.673463364202599 2.0 1.0 1 0 1 0
19 101.777861086 34541.4423828 13.0476351511 2 0.2 27.2003805059 2.0 1.0 1 0 0 0 19 101.77786108610977 34541.4423828125 13.047635151061126 2 0.2 27.200380505930994 2.0 1.0 1 0 0 0
20 101.778316176 33541.15625 12.7971980864 1 0.1 nan 1.0 1.0 1 0 0 0 20 101.77831617602112 33541.15625 12.797198086352594 1 0.1 nan 1.0 1.0 1 0 0 0
21 101.778950382 30378.1269531 11.465730304 3 0.3 5.6452635977 3.0 1.0 1 0 1 0 21 101.77895038214314 30378.126953125 11.466872013373568 3 0.3 5.645263597702305 3.0 1.0 1 0 1 0
22 101.77924867 33468.6142578 12.514458002 2 0.2 28.6592456843 2.0 1.0 1 0 0 0 22 101.77924866974867 33468.6142578125 12.514653841999834 2 0.2 28.65924568431461 2.0 1.0 1 0 0 0
23 101.77964831 31006.5864258 11.9330965986 4 0.4 22.4750843872 4.0 1.0 1 0 0 0 23 101.77964830967595 31006.58642578125 11.933796404315894 4 0.4 22.475084387245317 4.0 1.0 1 0 0 0
24 101.77999156 30660.2265625 11.6980163048 1 0.1 nan 1.0 1.0 1 0 0 0 24 101.77999156012018 30660.2265625 11.698016304752821 1 0.1 nan 1.0 1.0 1 0 0 0
25 101.7802938 27678.9160156 10.7373559474 3 0.3 3.67107118461 3.0 1.0 1 0 1 0 25 101.7802938004055 27678.916015625 10.737392529997663 3 0.3 3.671071184605379 3.0 1.0 1 0 1 0
26 101.780889738 28330.7539062 10.7263414054 3 0.3 7.43916580344 3.0 1.0 1 0 1 0 26 101.78088973847669 28330.75390625 10.726449952980852 3 0.3 7.439165803436667 3.0 1.0 1 0 1 0
27 101.781166737 30922.6103516 12.1240743046 2 0.2 17.8866562173 2.0 1.0 1 0 1 0 27 101.78116673715209 30922.6103515625 12.12420092870051 2 0.2 17.88665621731424 2.0 1.0 1 0 1 0
28 101.781573867 30871.9589844 12.0861630787 3 0.3 18.135680603 3.0 1.0 1 0 1 0 28 101.78157386736056 30871.958984375 12.087427554312171 3 0.3 18.135680602992984 3.0 1.0 1 0 1 0
29 101.782027196 37854.2391183 14.4745642608 7 0.7 15.191408057 7.0 1.0 1 0 1 0 29 101.78202719612914 37854.23911830357 14.475331224259877 7 0.7 15.191408056952879 7.0 1.0 1 0 1 0
30 101.782258282 36488.1171875 14.558147767 1 0.1 nan 1.0 1.0 1 0 0 0 30 101.78225828169656 36488.1171875 14.55814776699417 1 0.1 nan 1.0 1.0 1 0 0 0
31 101.78255315 31276.8271484 11.9478572064 4 0.4 14.2901695006 4.0 1.0 1 0 1 0 31 101.78255314975661 31276.8271484375 11.94883010775738 4 0.4 14.29016950060508 4.0 1.0 1 0 1 0
32 101.782960793 35079.5397135 13.2258264528 3 0.3 18.8259928443 3.0 1.0 1 0 1 0 32 101.78296079329341 35079.539713541664 13.226130864843014 3 0.3 18.825992844286443 3.0 1.0 1 0 1 0
33 101.783306568 27601.1855469 10.4869504452 2 0.2 4.12336147226 2.0 1.0 1 0 1 0 33 101.78330656814789 27601.185546875 10.48705035792852 2 0.2 4.1233614722618155 2.0 1.0 1 0 1 0
34 101.783551695 30512.7109375 11.4780957032 4 0.4 11.3320608671 4.0 1.0 1 0 1 0 34 101.78355169522729 30512.7109375 11.478311753928994 4 0.4 11.332060867136883 4.0 1.0 1 0 1 0
35 101.783934368 36408.4873047 14.1709914265 6 0.6 23.7479821355 6.0 1.0 1 0 0 0 35 101.78393436816549 36408.4873046875 14.171727769665914 6 0.6 23.747982135482072 6.0 1.0 1 0 0 0
36 101.784513206 36275.29375 13.982735417 5 0.5 17.9177469008 5.0 1.0 1 0 1 0 36 101.78451320617994 36275.29375 13.982954929045889 5 0.5 17.91774690077074 5.0 1.0 1 0 1 0
37 101.784794482 28211.6201172 11.2276749833 2 0.2 10.9236493644 2.0 1.0 1 0 1 0 37 101.78479448202967 28211.6201171875 11.227817448067897 2 0.2 10.923649364444845 2.0 1.0 1 0 1 0
38 101.78503503 27375.6393229 10.5444074502 3 0.3 3.54293968257 3.0 1.0 1 0 1 0 38 101.78503503042043 27375.639322916668 10.54447426879925 3 0.3 3.542939682573721 3.0 1.0 1 0 1 0
39 101.785241914 28881.3115234 11.2929617899 2 0.2 12.2007937569 2.0 1.0 1 0 1 0 39 101.78524191356985 28881.3115234375 11.292961789859948 2 0.2 12.200793756922632 2.0 1.0 1 0 1 0
40 101.785521731 31990.8730469 11.906689301 1 0.1 nan 1.0 1.0 1 0 0 0 40 101.7855217312049 31990.873046875 11.906914345022834 1 0.1 nan 1.0 1.0 1 0 0 0
41 101.78587928 38187.5950521 14.6534414982 3 0.3 25.6294976936 3.0 1.0 1 0 0 0 41 101.78587928024895 38187.595052083336 14.653537582378265 3 0.3 25.62949769355724 3.0 1.0 1 0 0 0
42 101.786192531 34321.7460938 13.6299055809 1 0.1 nan 1.0 1.0 1 0 0 0 42 101.78619253085883 34321.74609375 13.630227365705679 1 0.1 nan 1.0 1.0 1 0 0 0
43 101.786403562 28921.0570312 11.151531328 5 0.5 10.4107435987 5.0 1.0 1 0 1 0 43 101.78640356187637 28921.05703125 11.152114322073917 5 0.5 10.410743598676126 5.0 1.0 1 0 1 0
44 101.786776769 30197.3951823 11.0918968169 3 0.3 10.9584261249 3.0 1.0 1 0 1 0 44 101.78677676905949 30197.395182291668 11.092226963945352 3 0.3 10.95842612485824 3.0 1.0 1 0 1 0
45 101.78709869 25948.7089844 10.3047919659 1 0.1 nan 1.0 1.0 1 0 0 0 45 101.78709869037199 25948.708984375 10.305035249006966 1 0.1 nan 1.0 1.0 1 0 0 0
46 101.787960585 30159.4296875 11.5069436786 1 0.1 nan 1.0 1.0 1 0 0 0 46 101.78796058503306 30159.4296875 11.506943678554928 1 0.1 nan 1.0 1.0 1 0 0 0
47 101.788209622 28098.8203125 10.9070329765 1 0.1 nan 1.0 1.0 1 0 0 0 47 101.78820962188603 28098.8203125 10.907032976468043 1 0.1 nan 1.0 1.0 1 0 0 0
48 101.788779334 36877.4960938 13.7254424893 1 0.1 nan 1.0 1.0 1 0 0 0 48 101.78877933358748 36877.49609375 13.72570190891018 1 0.1 nan 1.0 1.0 1 0 0 0
49 101.789142045 25685.3710938 10.2002148102 1 0.1 nan 1.0 1.0 1 0 0 0 49 101.7891420445816 25685.37109375 10.200455624374241 1 0.1 nan 1.0 1.0 1 0 0 0
50 101.789393072 33440.5078125 12.9804994446 1 0.1 nan 1.0 1.0 1 0 0 0 50 101.78939307203959 33440.5078125 12.98049944461613 1 0.1 nan 1.0 1.0 1 0 0 0
51 101.789979587 30370.3769531 12.1172718546 1 0.1 nan 1.0 1.0 1 0 0 0 51 101.78997958713451 30370.376953125 12.11727185458541 1 0.1 nan 1.0 1.0 1 0 0 0
52 101.792263999 28546.9765625 11.3334774309 1 0.1 nan 1.0 1.0 1 0 0 0 52 101.79226399944761 28546.9765625 11.336291977896597 1 0.1 nan 1.0 1.0 1 0 0 0
53 103.038954516 32797.6232639 12.6164363987 9 0.9 13.3224048039 9.0 1.0 1 1 1 1 53 103.0389545162232 32797.62326388889 12.616981791040256 9 0.9 13.322404803855195 9.0 1.0 1 1 1 1
54 104.106978239 25770.8183594 10.0033795921 1 0.1 nan 1.0 1.0 1 0 0 0 54 104.10697823897837 25770.818359375 10.003379592104404 1 0.1 nan 1.0 1.0 1 0 0 0
55 112.052302597 121733.801562 46.9193741115 10 1.0 6.21722884493 10.0 1.0 1 1 1 1 55 112.05230259726927 121733.8015625 46.92106878403354 10 1.0 6.217228844933996 10.0 1.0 1 1 1 1
56 114.066182793 60262.403125 23.1806317936 10 1.0 7.02708067277 10.0 1.0 1 1 1 1 56 114.06618279280511 60262.403125 23.181411724611298 10 1.0 7.027080672774515 10.0 1.0 1 1 1 1
57 116.070603392 31275.6937934 12.0184909928 9 0.9 12.993820821 9.0 1.0 1 1 1 1 57 116.07060339230298 31275.693793402777 12.018908779928958 9 0.9 12.993820821024535 9.0 1.0 1 1 1 1
58 118.08569842 26717.422526 10.2946460729 3 0.3 9.8017899619 3.0 1.0 1 0 1 0 58 118.0856984203125 26717.422526041668 10.29567746644905 3 0.3 9.801789961899155 3.0 1.0 1 0 1 0
59 118.086255296 323197.540625 124.265641939 10 1.0 5.886612596 10.0 1.0 1 1 1 1 59 118.0862552959962 323197.540625 124.27011726963016 10 1.0 5.886612596002049 10.0 1.0 1 1 1 1
60 118.086654839 27104.4546875 10.4330709922 5 0.5 3.14901670751 5.0 1.0 1 0 1 0 60 118.0866548393647 27104.4546875 10.433108950716449 5 0.5 3.149016707512639 5.0 1.0 1 0 1 0
61 123.013845356 39253.1345703 15.06389601 10 1.0 13.5618723162 10.0 1.0 1 1 1 1 61 123.0138453564294 39253.1345703125 15.064413407728434 10 1.0 13.561872316173314 10.0 1.0 1 1 1 1
62 123.055297502 31510.9865723 12.2482251026 8 0.8 13.7679133057 8.0 1.0 1 1 1 1 62 123.05529750196203 31510.986572265625 12.248623302642816 8 0.8 13.767913305730033 8.0 1.0 1 1 1 1
63 126.021931211 27008.9921875 10.7228799771 1 0.1 nan 1.0 1.0 1 0 0 0 63 126.02193121057209 27008.9921875 10.725542888784796 1 0.1 nan 1.0 1.0 1 0 0 0
64 128.010840885 32085.1751302 12.3165216688 9 0.9 23.440879083 9.0 1.0 1 1 0 0 64 128.01084088491064 32085.175130208332 12.316963399962951 9 0.9 23.440879082992925 9.0 1.0 1 1 0 0
65 128.994860012 32113.2832031 12.4074150744 6 0.6 14.1768452696 6.0 1.0 1 0 1 0 65 128.99486001190158 32113.283203125 12.408028033334062 6 0.6 14.176845269554573 6.0 1.0 1 0 1 0
66 130.049215993 37624.1371528 14.588705291 9 0.9 14.4178987898 9.0 1.0 1 1 1 1 66 130.04921599324578 37624.13715277778 14.589255264999593 9 0.9 14.417898789822553 9.0 1.0 1 1 1 1
67 130.049876889 147514.230469 56.8812925301 10 1.0 9.67101592345 10.0 1.0 1 1 1 1 67 130.0498768894177 147514.23046875 56.8833473930451 10 1.0 9.671015923452547 10.0 1.0 1 1 1 1
68 131.009839484 30733.4636719 11.7955759393 10 1.0 11.1927166935 10.0 1.0 1 1 1 1 68 131.0098394842666 30733.463671875 11.795999901379275 10 1.0 11.19271669346332 10.0 1.0 1 1 1 1
69 131.010521887 93111.3210937 35.758377678 10 1.0 15.1018710816 10.0 1.0 1 1 1 1 69 131.01052188673293 93111.32109375 35.75965757702188 10 1.0 15.101871081589533 10.0 1.0 1 1 1 1
70 131.018942514 54322.8375 20.9180183987 10 1.0 16.2439372357 10.0 1.0 1 1 1 1 70 131.0189425139915 54322.8375 20.918846520469728 10 1.0 16.243937235658887 10.0 1.0 1 1 1 1
71 132.074591092 34920.3964844 13.4405903912 10 1.0 9.39074188168 10.0 1.0 1 1 1 1 71 132.07459109200278 34920.396484375 13.441058301541968 10 1.0 9.390741881680983 10.0 1.0 1 1 1 1
72 132.075013619 80519.4710938 30.9744155312 10 1.0 7.56550454748 10.0 1.0 1 1 1 1 72 132.07501361852397 80519.47109375 30.97556275667401 10 1.0 7.565504547482196 10.0 1.0 1 1 1 1
73 132.075574261 424352.515625 163.278684085 10 1.0 3.63375784894 10.0 1.0 1 1 1 1 73 132.07557426113937 424352.515625 163.28455368957387 10 1.0 3.6337578489374427 10.0 1.0 1 1 1 1
74 132.076109332 1927520.625 741.681781563 10 1.0 2.63465129636 10.0 1.0 1 1 1 1 74 132.07610933179484 1927520.625 741.7084408301661 10 1.0 2.6346512963551576 10.0 1.0 1 1 1 1
75 132.076669638 19582926.8 7537.21683915 10 1.0 3.88024463677 10.0 1.0 1 1 1 1 75 132.07666963785772 19582926.8 7537.491605792248 10 1.0 3.880244636771604 10.0 1.0 1 1 1 1
76 132.077197703 2238931.725 861.641794933 10 1.0 3.3984460211 10.0 1.0 1 1 1 1 76 132.07719770339094 2238931.725 861.6730508474787 10 1.0 3.398446021097475 10.0 1.0 1 1 1 1
77 132.078013368 48363.871875 18.650830993 5 0.5 6.04062242534 5.0 1.0 1 0 1 0 77 132.07801336779409 48363.871875 18.651938650760982 5 0.5 6.0406224253445355 5.0 1.0 1 0 1 0
78 132.078371184 28818.4515625 11.0800058153 10 1.0 6.44695117975 18.0 0.2 1 1 1 1 78 132.07837118365757 28818.4515625 11.080400975587073 10 1.0 6.446951179746177 18.0 0.19999999999999996 1 1 1 1
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80 132.101253754 74106.5054687 28.505300624 10 1.0 7.47559924556 10.0 1.0 1 1 1 1 80 132.10125375433566 74106.50546875 28.506325195663482 10 1.0 7.47559924555832 10.0 1.0 1 1 1 1
81 132.101915057 244051.21875 93.8495694361 10 1.0 7.31852215201 10.0 1.0 1 1 1 1 81 132.10191505671938 244051.21875 93.8529588323164 10 1.0 7.318522152008193 10.0 1.0 1 1 1 1
82 133.034596084 39359.6835938 14.6492883407 1 0.1 nan 1.0 1.0 1 0 0 0 82 133.03459608365645 39359.68359375 14.649565221658172 1 0.1 nan 1.0 1.0 1 0 0 0
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84 133.073804849 126845.666406 48.8488904298 10 1.0 7.21712330164 10.0 1.0 1 1 1 1 84 133.0738048489756 126845.66640625 48.85060139095447 10 1.0 7.2171233016444445 10.0 1.0 1 1 1 1
85 133.078935035 39275.7597656 15.1181373383 10 1.0 5.40754781314 10.0 1.0 1 1 1 1 85 133.07893503518466 39275.759765625 15.118683027952992 10 1.0 5.407547813144529 10.0 1.0 1 1 1 1
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87 133.080116687 559205.71875 215.1859802 10 1.0 3.46035590317 10.0 1.0 1 1 1 1 87 133.08011668727465 559205.71875 215.19385926289357 10 1.0 3.460355903169622 10.0 1.0 1 1 1 1
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89 133.105280127 27935.4550781 10.3973024934 1 0.1 nan 1.0 1.0 1 0 0 0 89 133.10528012698825 27935.455078125 10.397499009079395 1 0.1 nan 1.0 1.0 1 0 0 0
90 134.081000219 59811.684375 23.0885194725 10 1.0 10.9476821707 10.0 1.0 1 1 1 1 90 134.08100021930534 59811.684375 23.08941665315167 10 1.0 10.947682170655275 10.0 1.0 1 1 1 1
91 134.996426657 31809.9726562 11.8393599492 1 0.1 nan 1.0 1.0 1 0 0 0 91 134.99642665651908 31809.97265625 11.839583720660164 1 0.1 nan 1.0 1.0 1 0 0 0
92 135.002861285 52213.2132812 20.1092627261 10 1.0 15.1407930625 10.0 1.0 1 1 1 1 92 135.00286128454152 52213.21328125 20.109978462285497 10 1.0 15.140793062456545 10.0 1.0 1 1 1 1
93 136.046911654 28072.8763021 10.9117326034 3 0.3 5.4783785494 3.0 1.0 1 0 1 0 93 136.0469116540663 28072.876302083332 10.91259918684446 3 0.3 5.478378549403543 3.0 1.0 1 0 1 0
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