Mercurial > repos > tomnl > create_sqlite_db
view test-data/input.msp @ 23:a429aae0ebfe draft
planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit 04023134d8f28e85927ca293373c506484149ead-dirty
author | tomnl |
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date | Sat, 02 Jun 2018 05:20:58 -0400 |
parents | 9ab472c5714c |
children |
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NAME: 1-1-1483 PRECURSORMZ: 70.0658950805664 Comment: Num Peaks: 8 50.4781379699707 3487.4296875 51.0193099975586 3390.96948242188 53.0031509399414 10011.958984375 53.5898513793945 4252.7880859375 54.3787727355957 3541.5107421875 69.0455169677734 9650.0107421875 70.0660934448242 37168.609375 82.9910659790039 4077.36694335938 NAME: 2-1-1823 PRECURSORMZ: 72.0815277099609 Comment: Num Peaks: 6 51.773567199707 818.313903808594 54.0346794128418 1247.91137695312 54.6847991943359 967.616882324219 56.050350189209 1780.01037597656 58.4994125366211 975.196228027344 72.0814056396484 1660.50390625 NAME: 2-1-1857 PRECURSORMZ: 72.08154296875 Comment: Num Peaks: 4 56.0504341125488 1838.78173828125 59.9103507995605 701.556762695312 63.7723731994629 650.224975585938 72.0814590454102 760.228637695312 NAME: 5-1-1606 PRECURSORMZ: 76.0400390625 Comment: Num Peaks: 4 53.2376174926758 3224.35571289062 60.3291244506836 3193.19482421875 73.7529830932617 3305.61401367188 82.5309600830078 2965.41772460938 NAME: 9-1-177 PRECURSORMZ: 79.0218658447266 Comment: Num Peaks: 7 53.6282501220703 15316.7431640625 59.967342376709 251727.734375 61.0115814208984 80113.8046875 62.9908714294434 93065.1015625 63.9986305236816 950876.9375 79.0219345092773 33032.984375 95.4936447143555 13826.033203125 NAME: 9-1-184 PRECURSORMZ: 79.0218811035156 Comment: Num Peaks: 5 59.1125831604004 67799.1953125 59.9673652648926 345613.1875 62.9906845092773 117693.296875 63.9986686706543 1585970.25 80.5974655151367 66719.4609375 NAME: 9-1-212 PRECURSORMZ: 79.0218887329102 Comment: Num Peaks: 12 53.1700401306152 2441.47143554688 55.1893730163574 2006.07958984375 58.9013671875 2539.39086914062 59.9673500061035 13423.1376953125 61.0115776062012 4831.0986328125 62.9908828735352 3668.52905273438 63.9986190795898 54386.6640625 73.8388671875 2330.30126953125 78.5768051147461 2563.25 79.0221328735352 2581.44604492188 96.8009872436523 2530.70141601562 99.6652908325195 2961.3095703125 NAME: 11-1-1284 PRECURSORMZ: 79.9903564453125 Comment: Num Peaks: 3 51.6917915344238 584.212829589844 53.0398750305176 649.807922363281 97.3154754638672 596.341003417969 NAME: 19-1-1497 PRECURSORMZ: 86.060661315918 Comment: Num Peaks: 4 53.0031318664551 9658.7939453125 53.1939277648926 1998.81518554688 80.3447494506836 2044.23645019531 101.307479858398 2181.85522460938 NAME: 19-1-1498 PRECURSORMZ: 86.0606307983398 Comment: Num Peaks: 11 52.6782836914062 1061.12646484375 53.0032196044922 15176.8583984375 53.1121788024902 1193.6044921875 53.9984169006348 2790.28930664062 54.0287094116211 999.250427246094 56.7024726867676 1171.42797851562 69.0346069335938 1878.03894042969 72.9083633422852 1256.455078125 74.0740356445312 1324.07055664062 80.5324630737305 1329.61022949219 91.0167770385742 1362.0029296875 NAME: 19-1-1500 PRECURSORMZ: 86.0606536865234 Comment: Num Peaks: 5 53.0031509399414 29580.330078125 55.3490409851074 4989.64990234375 61.990592956543 4089.9619140625 63.2290992736816 4168.97412109375 67.6647109985352 5392.48779296875