Mercurial > repos > tomnl > assess_purity_msms

view test-data/file01.msp @ 27:81c4fdfbcb5a draft

Find changesets by keywords (author, files, the commit message), revision number or hash, or revset expression.
planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit a598583947118bd50cfe5ae12d955c20d6e502a6
author tomnl
date Tue, 17 Jul 2018 12:18:03 -0400
parents
children
line wrap: on
line source

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