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Commit message:
planemo upload for repository https://github.com/workflow4metabolomics/tool-bank-golm-lib_search.git commit eda71915d21e2d24efc3e04a3ab21758d8c3f409 |
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removed:
test-data/KHanaoka_peakspectra.msp |
| b |
| diff -r e3d43b8c987b -r 4dc76dcbd1e7 test-data/KHanaoka_peakspectra.msp --- a/test-data/KHanaoka_peakspectra.msp Mon Dec 05 08:32:04 2016 -0500 +++ /dev/null Thu Jan 01 00:00:00 1970 +0000 |
| b |
| b'@@ -1,995 +0,0 @@\n-Name: Unknown 1\n-DB.idx: -1\n-rt: 21.716\n-Class: Unknown\n-rt.sd: 0.0034\n-Num Peaks: 35\n- 34 1872; 36 4218; 37 39432; 38 76320; 39 394560; \n- 40 63368; 41 582144; 42 606848; 43 431680; 44 44888; \n- 45 499264; 46 17176; 47 15103; 49 2157; 50 3843; \n- 51 2281; 52 2201; 53 15926; 54 5466; 55 274496; \n- 56 14999; 60 2631168; 61 67568; 62 10726; 68 8040; \n- 69 45736; 70 23664; 71 72120; 73 877056; 74 33392; \n- 75 3772; 87 39608; 88 45784; 89 14154; 90 896; \n-\n-Name: Unknown 2\n-DB.idx: -2\n-rt: 3.513\n-Class: Unknown\n-rt.sd: 0.0015\n-Num Peaks: 49\n- 38 1882; 39 92080; 40 19592; 41 480832; 42 32344; \n- 43 236928; 44 9597; 50 1989; 51 6101; 52 3524; \n- 53 33960; 54 7422; 55 180224; 56 962752; 57 2366976; \n- 58 104656; 59 1985; 63 1022; 65 6145; 66 2078; \n- 67 18928; 68 3234; 69 57408; 70 19928; 71 145600; \n- 72 8488; 77 5033; 78 1226; 79 5690; 80 844; \n- 81 5024; 82 1579; 83 32352; 84 4554; 85 118632; \n- 86 8063; 93 979; 95 1734; 97 10545; 98 6114; \n- 99 106120; 100 8584; 111 2090; 112 72392; 113 45768; \n- 114 3665; 154 609; 155 9266; 156 1436; \n-\n-Name: Unknown 3\n-DB.idx: -3\n-rt: 23.84\n-Class: Unknown\n-rt.sd: 0.0026\n-Num Peaks: 54\n- 37 7073; 38 20224; 39 248384; 40 35488; 41 550912; \n- 42 136384; 43 525248; 44 31760; 45 194496; 46 8497; \n- 47 6316; 49 2397; 50 19512; 51 29464; 52 10230; \n- 53 63488; 54 19584; 55 630656; 56 186368; 57 1009344; \n- 58 51240; 59 165376; 60 333120; 61 23528; 62 4084; \n- 63 3412; 65 3729; 67 8115; 68 3773; 69 46152; \n- 70 45040; 71 9504; 73 576704; 74 555520; 75 51688; \n- 76 3653; 77 3575; 81 9534; 82 3455; 83 158144; \n- 84 9385; 87 64288; 88 5187; 97 16776; 98 6155; \n- 99 12940; 100 3073; 101 34232; 102 2837; 103 5049; \n- 104 2812; 115 1848; 117 3546; 132 1975; \n-\n-Name: Unknown 4\n-DB.idx: -4\n-rt: 24.238\n-Class: Unknown\n-rt.sd: 0.0028\n-Num Peaks: 45\n- 37 3606; 38 10762; 39 129176; 40 21632; 41 270080; \n- 42 135168; 43 183936; 44 14971; 45 164352; 46 5267; \n- 47 4082; 50 5846; 51 9314; 52 3492; 53 20872; \n- 54 7617; 55 156672; 56 91288; 57 100008; 58 6730; \n- 59 19280; 60 922752; 61 93328; 62 6487; 63 2150; \n- 65 2738; 67 4649; 68 5233; 69 31944; 70 30864; \n- 71 7478; 73 431168; 74 61272; 75 4651; 80 4459; \n- 83 10227; 87 129904; 97 4419; 98 4035; 99 8020; \n- 105 2057; 119 3784; 129 740; 159 4461; 160 722; \n-\n-Name: Unknown 5\n-DB.idx: -5\n-rt: 26.546\n-Class: Unknown\n-rt.sd: 0.0025\n-Num Peaks: 60\n- 33 3190; 36 2157; 37 34912; 38 84760; 39 481600; \n- 40 120640; 41 529984; 42 236608; 43 278784; 44 32992; \n- 45 97512; 46 5979; 47 8652; 49 10603; 50 58488; \n- 51 87648; 52 35960; 53 84160; 54 27776; 55 256192; \n- 56 78720; 57 27384; 58 46680; 59 3982; 61 25072; \n- 62 40008; 63 64536; 64 16117; 65 200256; 66 258688; \n- 67 431680; 68 56176; 69 148288; 70 82096; 71 41056; \n- 72 2862; 77 6989; 78 1293; 79 32568; 80 2950; \n- 81 9911; 82 14707; 83 45944; 84 51584; 85 4913; \n- 86 1722; 92 1862; 93 14284; 94 15111; 95 54368; \n- 97 862592; 98 107328; 99 331648; 100 23656; 101 2449; \n- 110 2377; 111 53768; 112 409600; 113 29776; 114 2942; \n-\n-Name: Unknown 6\n-DB.idx: -6\n-rt: 23.158\n-Class: Unknown\n-rt.sd: 0.0035\n-Num Peaks: 33\n- 37 3709; 38 9334; 39 84024; 40 11251; 41 150592; \n- 42 93848; 43 101920; 44 11079; 45 123480; 46 5126; \n- 47 3737; 49 1890; 50 8897; 51 9698; 52 3186; \n- 53 14335; 54 5375; 55 101248; 56 53168; 57 25432; \n- 59 11406; 60 799488; 61 38376; 62 3749; 69 4646; \n- 73 301120; 74 28576; 75 2881; 82 2492; 83 5137; \n- 85 7704; 87 18536; 101 1836; \n-\n-Name: Unknown 7\n-DB.idx: -7\n-rt: 19.993\n-Class: Unknown\n-'..b'73; 37 5160; 38 10876; 39 75120; 40 23392; \n- 41 168000; 42 216640; 43 194240; 44 19136; 49 1081; \n- 50 5031; 51 6820; 52 6564; 53 11846; 54 16062; \n- 55 113368; 56 45456; 58 20848; 68 8387; 70 70072; \n- 71 32624; 81 2986; 82 6637; 98 66552; 99 358784; \n- 100 22944; 101 1811; \n-\n-Name: Unknown 77\n-DB.idx: -77\n-rt: 21.336\n-Class: Unknown\n-rt.sd: 0.0052\n-Num Peaks: 57\n- 37 1762; 38 4149; 39 45912; 40 10100; 41 101384; \n- 42 24760; 43 188608; 44 11271; 45 14933; 49 1024; \n- 50 4455; 51 6470; 52 2867; 53 18296; 54 8838; \n- 55 58168; 56 122136; 57 50072; 58 99160; 59 14146; \n- 63 1062; 65 3140; 66 1321; 67 15114; 68 17552; \n- 69 37416; 70 22688; 71 226624; 72 20648; 77 3079; \n- 79 3851; 80 913; 81 11450; 82 6495; 83 3289; \n- 84 28784; 85 80680; 86 8077; 87 7288; 93 2543; \n- 95 116288; 96 9813; 97 18256; 99 4363; 100 6846; \n- 109 2516; 110 66224; 111 7536; 112 2475; 113 10898; \n- 114 832; 123 1617; 125 1099; 128 44704; 129 3917; \n- 140 733; 156 3370; \n-\n-Name: Unknown 78\n-DB.idx: -78\n-rt: 1.539\n-Class: Unknown\n-rt.sd: 0.0027\n-Num Peaks: 5\n- 41 18320; 42 30264; 43 96280; 44 175872; 71 5191; \n-\n-Name: Unknown 79\n-DB.idx: -79\n-rt: 3.856\n-Class: Unknown\n-rt.sd: 0.005\n-Num Peaks: 19\n- 37 1496; 38 3323; 39 25816; 40 4451; 41 58112; \n- 42 18944; 44 131200; 45 17200; 50 2820; 51 2634; \n- 52 909; 53 4564; 55 9369; 57 56040; 58 51176; \n- 67 2231; 68 1267; 71 4428; 85 2075; \n-\n-Name: Unknown 80\n-DB.idx: -80\n-rt: 9.59\n-Class: Unknown\n-rt.sd: 0\n-Num Peaks: 9\n- 38 1147; 39 7072; 50 915; 53 3684; 57 91800; \n- 58 4287; 59 2754; 67 2405; 68 2017; \n-\n-Name: Unknown 81\n-DB.idx: -81\n-rt: 1.835\n-Class: Unknown\n-rt.sd: 0.0027\n-Num Peaks: 5\n- 37 3251; 38 3725; 57 26000; 58 91472; 59 3480; \n-\n-Name: Unknown 82\n-DB.idx: -82\n-rt: 25.149\n-Class: Unknown\n-rt.sd: 0.0059\n-Num Peaks: 55\n- 39 13048; 41 26008; 43 52064; 51 5166; 52 2079; \n- 53 6989; 55 18096; 60 42016; 61 5468; 63 2229; \n- 65 4990; 67 4048; 68 1801; 69 7099; 70 5910; \n- 71 6618; 73 24528; 77 13327; 78 3002; 79 13280; \n- 80 1774; 81 4542; 83 2732; 84 2345; 87 10928; \n- 88 5885; 91 14913; 93 9365; 95 7327; 96 1669; \n- 101 3775; 102 694; 105 8665; 107 11170; 109 4780; \n- 115 3417; 116 1690; 119 5552; 121 7269; 122 5696; \n- 129 1682; 131 2352; 133 5886; 134 1347; 135 10330; \n- 136 2725; 144 1203; 147 1465; 149 5619; 159 3219; \n- 162 2148; 163 737; 177 72744; 178 9094; 192 2312; \n-\n-Name: Unknown 83\n-DB.idx: -83\n-rt: 24.011\n-Class: Unknown\n-rt.sd: 0.0055\n-Num Peaks: 16\n- 53 4710; 65 1762; 66 3244; 67 6272; 79 3060; \n- 80 899; 81 15255; 82 2946; 95 29704; 96 3518; \n- 97 4416; 98 5238; 104 1486; 111 3146; 123 1175; \n- 154 636; \n-\n-Name: Unknown 84\n-DB.idx: -84\n-rt: 25.326\n-Class: Unknown\n-rt.sd: 0.0043\n-Num Peaks: 16\n- 38 2086; 39 7881; 52 2800; 53 4601; 55 11121; \n- 66 11622; 69 3875; 71 9009; 80 1160; 84 4865; \n- 94 22680; 97 5436; 109 17560; 111 2595; 126 20216; \n- 127 1557; \n-\n-Name: Unknown 85\n-DB.idx: -85\n-rt: 21.652\n-Class: Unknown\n-rt.sd: 0.0059\n-Num Peaks: 17\n- 65 2127; 67 7430; 77 3782; 79 4142; 81 7575; \n- 91 4626; 93 2850; 94 1628; 95 4707; 107 3144; \n- 109 8172; 119 2064; 123 7560; 137 9572; 151 1039; \n- 152 8226; 153 922; \n-\n-Name: Unknown 86\n-DB.idx: -86\n-rt: 8.182\n-Class: Unknown\n-rt.sd: 0.0051\n-Num Peaks: 5\n- 39 6052; 53 2158; 55 9398; 83 4878; 84 3889; \n-\n-Name: Unknown 87\n-DB.idx: -87\n-rt: 16.837\n-Class: Unknown\n-rt.sd: 0\n-Num Peaks: 8\n- 65 1470; 66 1131; 67 7522; 93 763; 95 4282; \n- 96 911; 109 1473; 124 2052; \n-\n-Name: Unknown 88\n-DB.idx: -88\n-rt: 5.355\n-Class: Unknown\n-rt.sd: 0.006\n-Num Peaks: 6\n- 38 1373; 39 7330; 63 771; 65 1045; 91 7439; \n- 92 4675; \n-\n' |