Mercurial > repos > tomnl > create_msp

annotate test-data/file01.msp @ 18:49e063070647 draft

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planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
author tomnl
date Tue, 17 Jul 2018 12:30:24 -0400
parents
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
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18
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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diff changeset
1 NAME: 1-1-1483
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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2 PRECURSORMZ: 70.0658950805664
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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3 Comment:
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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4 Num Peaks: 8
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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5 50.4781379699707 3487.4296875
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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6 51.0193099975586 3390.96948242188
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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7 53.0031509399414 10011.958984375
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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8 53.5898513793945 4252.7880859375
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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9 54.3787727355957 3541.5107421875
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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10 69.0455169677734 9650.0107421875
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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11 70.0660934448242 37168.609375
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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12 82.9910659790039 4077.36694335938
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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13
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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14 NAME: 2-1-1823
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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15 PRECURSORMZ: 72.0815277099609
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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16 Comment:
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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17 Num Peaks: 6
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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18 51.773567199707 818.313903808594
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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19 54.0346794128418 1247.91137695312
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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20 54.6847991943359 967.616882324219
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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21 56.050350189209 1780.01037597656
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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22 58.4994125366211 975.196228027344
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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23 72.0814056396484 1660.50390625
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
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24
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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25 NAME: 2-1-1857
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
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26 PRECURSORMZ: 72.08154296875
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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27 Comment:
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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28 Num Peaks: 4
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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29 56.0504341125488 1838.78173828125
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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30 59.9103507995605 701.556762695312
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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31 63.7723731994629 650.224975585938
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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32 72.0814590454102 760.228637695312
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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33
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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34 NAME: 5-1-1606
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
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35 PRECURSORMZ: 76.0400390625
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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36 Comment:
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
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37 Num Peaks: 4
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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diff changeset
38 53.2376174926758 3224.35571289062
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
39 60.3291244506836 3193.19482421875
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
40 73.7529830932617 3305.61401367188
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
41 82.5309600830078 2965.41772460938
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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42
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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43 NAME: 9-1-177
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
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44 PRECURSORMZ: 79.0218658447266
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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45 Comment:
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
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46 Num Peaks: 7
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
47 53.6282501220703 15316.7431640625
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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diff changeset
48 59.967342376709 251727.734375
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
49 61.0115814208984 80113.8046875
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
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50 62.9908714294434 93065.1015625
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
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51 63.9986305236816 950876.9375
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
52 79.0219345092773 33032.984375
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
53 95.4936447143555 13826.033203125
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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54
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
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55 NAME: 9-1-184
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
56 PRECURSORMZ: 79.0218811035156
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
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57 Comment:
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
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58 Num Peaks: 5
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
59 59.1125831604004 67799.1953125
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
60 59.9673652648926 345613.1875
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
61 62.9906845092773 117693.296875
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
62 63.9986686706543 1585970.25
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
tomnl
parents:
diff changeset
63 80.5974655151367 66719.4609375
49e063070647 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
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64