mzml 0.1.0 → 0.2.0
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- data/Rakefile +4 -4
- data/VERSION +1 -1
- data/bin/mzML2mgf.rb +53 -0
- data/lib/mzml.rb +28 -11
- data/mzml.gemspec +12 -9
- data/spec/mzml_spec.rb +33 -0
- data/spec/small.compressed.mzML +2107 -9043
- data/spec/small.mgf +102 -349
- data/spec/small.mzML +2121 -9046
- data/spec/spec_helper.rb +1 -1
- metadata +36 -20
data/spec/small.mgf
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END IONS
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461.3614502 5.75241375
|
28
|
+
463.718811 4.668572903
|
29
|
+
465.2086792 14.93584728
|
30
|
+
465.8127441 7.765468121
|
31
|
+
467.2386475 7.714337349
|
32
|
+
468.3571167 5.294529438
|
33
|
+
469.3236694 3.612401247
|
34
|
+
479.5741577 3.365628481
|
35
|
+
480.6315308 1.813826084
|
36
|
+
481.8273315 5.798970222
|
37
|
+
490.0960083 1.822803497
|
38
|
+
491.1592407 4.071849346
|
39
|
+
492.81427 6.269458771
|
40
|
+
493.4580688 3.769728899
|
41
|
+
498.3330688 3.883655548
|
42
|
+
501.2911987 4.668003082
|
43
|
+
503.2281494 4.208576679
|
44
|
+
506.4729614 7.169674397
|
45
|
+
507.5003052 5.757603168
|
46
|
+
519.4385986 2.254706621
|
47
|
+
521.3235474 6.445994377
|
48
|
+
523.3130493 10.68727207
|
49
|
+
535.5499268 3.156257629
|
50
|
+
543.0219116 2.470243692
|
51
|
+
546.2424927 3.856155634
|
52
|
+
559.0449219 9.004051208
|
53
|
+
561.1895752 5.988658428
|
54
|
+
567.2224731 3.773485899
|
55
|
+
570.3831177 3.338401556
|
56
|
+
571.208313 3.571824551
|
57
|
+
575.4297485 17.59938049
|
58
|
+
579.2825928 5.766992092
|
59
|
+
580.6271362 5.330102921
|
60
|
+
589.4867554 11.00474739
|
61
|
+
591.2870483 7.077944279
|
62
|
+
593.5586548 7.51500988
|
63
|
+
595.4191895 2.959779739
|
64
|
+
599.411438 3.637078524
|
65
|
+
603.2998657 4.47824049
|
66
|
+
607.7022705 2.251388788
|
67
|
+
609.2575684 6.838676929
|
68
|
+
610.2976685 3.573295593
|
69
|
+
615.6307983 2.678580284
|
70
|
+
617.7144165 14.07470036
|
71
|
+
623.0452271 3.378829479
|
72
|
+
628.4316406 10.65748215
|
73
|
+
631.3413696 8.506768227
|
74
|
+
635.5873413 2.765519142
|
75
|
+
641.1345825 2.470762253
|
76
|
+
647.2710571 1.388162494
|
77
|
+
649.5595703 6.162806511
|
78
|
+
651.3027954 5.565615654
|
79
|
+
671.0310669 10.42411232
|
80
|
+
675.2868042 8.396784782
|
81
|
+
677.0933838 5.41757822
|
82
|
+
678.5300903 3.122053146
|
83
|
+
683.0980225 5.838513374
|
84
|
+
686.1685181 3.197828293
|
85
|
+
687.6130981 4.891866207
|
86
|
+
689.4929199 3.610907793
|
87
|
+
691.6178589 4.205616474
|
88
|
+
699.3356323 2.258530378
|
89
|
+
701.3596802 2.03651619
|
90
|
+
702.4530029 2.467967033
|
91
|
+
703.3848877 13.7207737
|
92
|
+
717.8295898 2.95700717
|
93
|
+
719.7359619 3.55833602
|
94
|
+
720.4680176 3.555823803
|
95
|
+
727.4827271 7.09864378
|
96
|
+
732.9215698 5.168333054
|
97
|
+
735.7484131 3.383006334
|
98
|
+
741.9839478 3.558601141
|
99
|
+
744.446228 43.66746521
|
100
|
+
745.5824585 24.10937119
|
101
|
+
746.6261597 10.52173042
|
102
|
+
754.1419067 23.27846909
|
103
|
+
END IONS
|