ms-msrun 0.1.0 → 0.2.0
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- data/.gitignore +3 -0
- data/.gitmodules +3 -0
- data/History +18 -0
- data/{README → README.rdoc} +0 -0
- data/Rakefile +93 -107
- data/VERSION +1 -0
- data/lib/lmat.rb +141 -39
- data/lib/ms/msrun/nokogiri.rb +1 -0
- data/lib/ms/msrun/search_dev_notes.txt +47 -0
- data/spec/lmat_spec.rb +87 -11
- data/spec/metadata/opd1/000.v1.mzXML.yml +3 -0
- data/spec/metadata/opd1/000.v2.1.mzXML.yml +3 -0
- data/spec/metadata/opd1/020.mzData.xml.yml +3 -0
- data/spec/metadata/opd1/020.v2.0.readw.mzXML.yml +3 -0
- data/spec/ms/msrun/hpricot.rb +38 -0
- data/spec/ms/msrun/index_spec.rb +12 -13
- data/spec/ms/msrun/search_spec.rb +5 -4
- data/spec/ms/msrun/sha1_spec.rb +3 -6
- data/spec/ms/msrun/test_parsing_xml_frags/parse_test.rb +25 -0
- data/spec/ms/msrun/test_parsing_xml_frags/test1.xml +5 -0
- data/spec/ms/msrun/test_parsing_xml_frags/test2.xml +6 -0
- data/spec/ms/msrun/test_parsing_xml_frags/test3.xml +4 -0
- data/spec/ms/msrun/test_parsing_xml_frags/test4.xml +11 -0
- data/spec/ms/msrun/test_parsing_xml_frags/test_failures.rb +47 -0
- data/spec/ms/msrun_bm.rb +22 -0
- data/spec/ms/msrun_spec.rb +90 -109
- data/spec/ms/scan_spec.rb +5 -6
- data/spec/ms/spectrum/compare_spec.rb +31 -28
- data/spec/ms/spectrum/filter_spec.rb +15 -13
- data/spec/spec_helper.rb +21 -0
- data/spec/testfiles/lmat/tmp1.lmat +0 -0
- data/spec/testfiles/lmat/tmp1.lmata +44 -0
- data/spec/testfiles/lmat/tmp2.lmata +11 -0
- data/spec/testfiles/opd1/000.v1.mzXML +418 -0
- data/spec/testfiles/opd1/000.v1.mzXML.key.yml +51 -0
- data/spec/testfiles/opd1/000.v2.1.mzXML +382 -0
- data/spec/testfiles/opd1/000.v2.1.mzXML.key.yml +51 -0
- data/spec/testfiles/opd1/020.mzData.xml +683 -0
- data/spec/testfiles/opd1/020.mzData.xml.key.yml +43 -0
- data/spec/testfiles/opd1/020.v2.0.readw.mzXML +382 -0
- data/spec/testfiles/opd1/020.v2.0.readw.mzXML.key.yml +46 -0
- metadata +85 -34
metadata
CHANGED
@@ -1,15 +1,15 @@
|
|
1
1
|
--- !ruby/object:Gem::Specification
|
2
2
|
name: ms-msrun
|
3
3
|
version: !ruby/object:Gem::Version
|
4
|
-
version: 0.
|
4
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+
version: 0.2.0
|
5
5
|
platform: ruby
|
6
6
|
authors:
|
7
|
-
- John Prince
|
7
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+
- John T. Prince
|
8
8
|
autorequire:
|
9
9
|
bindir: bin
|
10
10
|
cert_chain: []
|
11
11
|
|
12
|
-
date: 2009-
|
12
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+
date: 2009-12-07 00:00:00 -07:00
|
13
13
|
default_executable:
|
14
14
|
dependencies:
|
15
15
|
- !ruby/object:Gem::Dependency
|
@@ -33,7 +33,7 @@ dependencies:
|
|
33
33
|
version: "0"
|
34
34
|
version:
|
35
35
|
- !ruby/object:Gem::Dependency
|
36
|
-
name:
|
36
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+
name: narray
|
37
37
|
type: :runtime
|
38
38
|
version_requirement:
|
39
39
|
version_requirements: !ruby/object:Gem::Requirement
|
@@ -42,49 +42,95 @@ dependencies:
|
|
42
42
|
- !ruby/object:Gem::Version
|
43
43
|
version: "0"
|
44
44
|
version:
|
45
|
-
|
45
|
+
- !ruby/object:Gem::Dependency
|
46
|
+
name: spec-more
|
47
|
+
type: :development
|
48
|
+
version_requirement:
|
49
|
+
version_requirements: !ruby/object:Gem::Requirement
|
50
|
+
requirements:
|
51
|
+
- - ">="
|
52
|
+
- !ruby/object:Gem::Version
|
53
|
+
version: "0"
|
54
|
+
version:
|
55
|
+
description: A library for working with LC/MS runs. Part of mspire. Has parsers for mzXML v1, 2, and 3, mzData (currently broken) and mzML (planned). Can convert to commonly desired search output (such as mgf). Fast random access of scans, and fast reading of the entire file.
|
46
56
|
email: jtprince@gmail.com
|
47
57
|
executables:
|
48
58
|
- base64_to_array.rb
|
49
|
-
- ms_to_obiwarp.rb
|
50
59
|
- ms_to_search.rb
|
60
|
+
- ms_to_obiwarp.rb
|
51
61
|
extensions: []
|
52
62
|
|
53
63
|
extra_rdoc_files:
|
54
|
-
- README
|
55
64
|
- LICENSE
|
65
|
+
- README.rdoc
|
56
66
|
files:
|
67
|
+
- .gitignore
|
68
|
+
- .gitmodules
|
69
|
+
- History
|
70
|
+
- LICENSE
|
71
|
+
- README.rdoc
|
72
|
+
- Rakefile
|
73
|
+
- VERSION
|
74
|
+
- bin/base64_to_array.rb
|
75
|
+
- bin/ms_to_obiwarp.rb
|
76
|
+
- bin/ms_to_search.rb
|
57
77
|
- lib/lmat.rb
|
58
|
-
- lib/ms/
|
59
|
-
- lib/ms/spectrum/compare.rb
|
60
|
-
- lib/ms/scan.rb
|
61
|
-
- lib/ms/msrun/sha1.rb
|
62
|
-
- lib/ms/msrun/regexp/mzxml.rb
|
63
|
-
- lib/ms/msrun/search.rb
|
64
|
-
- lib/ms/msrun/index.rb
|
65
|
-
- lib/ms/msrun/nokogiri/mzxml.rb
|
78
|
+
- lib/ms/msrun.rb
|
66
79
|
- lib/ms/msrun/axml/mzxml.rb
|
80
|
+
- lib/ms/msrun/index.rb
|
67
81
|
- lib/ms/msrun/mzxml.rb
|
68
82
|
- lib/ms/msrun/nokogiri.rb
|
69
|
-
- lib/ms/
|
83
|
+
- lib/ms/msrun/nokogiri/mzxml.rb
|
84
|
+
- lib/ms/msrun/regexp/mzxml.rb
|
85
|
+
- lib/ms/msrun/search.rb
|
86
|
+
- lib/ms/msrun/search_dev_notes.txt
|
87
|
+
- lib/ms/msrun/sha1.rb
|
70
88
|
- lib/ms/mzxml.rb
|
71
|
-
- lib/ms/
|
89
|
+
- lib/ms/precursor.rb
|
72
90
|
- lib/ms/precursor/lazy_parent.rb
|
73
|
-
-
|
74
|
-
-
|
75
|
-
-
|
91
|
+
- lib/ms/scan.rb
|
92
|
+
- lib/ms/spectrum/compare.rb
|
93
|
+
- lib/ms/spectrum/filter.rb
|
94
|
+
- spec/lmat_spec.rb
|
95
|
+
- spec/metadata/opd1/000.v1.mzXML.yml
|
96
|
+
- spec/metadata/opd1/000.v2.1.mzXML.yml
|
97
|
+
- spec/metadata/opd1/020.mzData.xml.yml
|
98
|
+
- spec/metadata/opd1/020.v2.0.readw.mzXML.yml
|
99
|
+
- spec/ms/msrun/hpricot.rb
|
100
|
+
- spec/ms/msrun/index_spec.rb
|
101
|
+
- spec/ms/msrun/scan_spec.rb
|
102
|
+
- spec/ms/msrun/search_spec.rb
|
103
|
+
- spec/ms/msrun/sha1_spec.rb
|
104
|
+
- spec/ms/msrun/test_parsing_xml_frags/parse_test.rb
|
105
|
+
- spec/ms/msrun/test_parsing_xml_frags/test1.xml
|
106
|
+
- spec/ms/msrun/test_parsing_xml_frags/test2.xml
|
107
|
+
- spec/ms/msrun/test_parsing_xml_frags/test3.xml
|
108
|
+
- spec/ms/msrun/test_parsing_xml_frags/test4.xml
|
109
|
+
- spec/ms/msrun/test_parsing_xml_frags/test_failures.rb
|
110
|
+
- spec/ms/msrun_bm.rb
|
111
|
+
- spec/ms/msrun_spec.rb
|
112
|
+
- spec/ms/scan_spec.rb
|
113
|
+
- spec/ms/spectrum/compare_spec.rb
|
114
|
+
- spec/ms/spectrum/filter_spec.rb
|
115
|
+
- spec/spec_helper.rb
|
116
|
+
- spec/testfiles/lmat/tmp1.lmat
|
117
|
+
- spec/testfiles/lmat/tmp1.lmata
|
118
|
+
- spec/testfiles/lmat/tmp2.lmata
|
119
|
+
- spec/testfiles/opd1/000.v1.mzXML
|
120
|
+
- spec/testfiles/opd1/000.v1.mzXML.key.yml
|
121
|
+
- spec/testfiles/opd1/000.v2.1.mzXML
|
122
|
+
- spec/testfiles/opd1/000.v2.1.mzXML.key.yml
|
123
|
+
- spec/testfiles/opd1/020.mzData.xml
|
124
|
+
- spec/testfiles/opd1/020.mzData.xml.key.yml
|
125
|
+
- spec/testfiles/opd1/020.v2.0.readw.mzXML
|
126
|
+
- spec/testfiles/opd1/020.v2.0.readw.mzXML.key.yml
|
76
127
|
has_rdoc: true
|
77
|
-
homepage: http://
|
128
|
+
homepage: http://jtprince.github.com/ms-msrun/
|
78
129
|
licenses: []
|
79
130
|
|
80
131
|
post_install_message:
|
81
132
|
rdoc_options:
|
82
|
-
- --
|
83
|
-
- README
|
84
|
-
- --title
|
85
|
-
- ms-msrun
|
86
|
-
- --line-numbers
|
87
|
-
- --inline-source
|
133
|
+
- --charset=UTF-8
|
88
134
|
require_paths:
|
89
135
|
- lib
|
90
136
|
required_ruby_version: !ruby/object:Gem::Requirement
|
@@ -102,17 +148,22 @@ required_rubygems_version: !ruby/object:Gem::Requirement
|
|
102
148
|
requirements: []
|
103
149
|
|
104
150
|
rubyforge_project: mspire
|
105
|
-
rubygems_version: 1.3.
|
151
|
+
rubygems_version: 1.3.5
|
106
152
|
signing_key:
|
107
153
|
specification_version: 3
|
108
|
-
summary:
|
154
|
+
summary: an mspire library for working with LC/MS runs (mzxml, mzData, mzML)
|
109
155
|
test_files:
|
110
|
-
- spec/ms/
|
111
|
-
- spec/ms/
|
156
|
+
- spec/ms/scan_spec.rb
|
157
|
+
- spec/ms/msrun_spec.rb
|
158
|
+
- spec/ms/msrun_bm.rb
|
112
159
|
- spec/ms/msrun/search_spec.rb
|
113
|
-
- spec/ms/msrun/sha1_spec.rb
|
114
160
|
- spec/ms/msrun/index_spec.rb
|
161
|
+
- spec/ms/msrun/hpricot.rb
|
115
162
|
- spec/ms/msrun/scan_spec.rb
|
116
|
-
- spec/ms/
|
117
|
-
- spec/ms/
|
163
|
+
- spec/ms/msrun/sha1_spec.rb
|
164
|
+
- spec/ms/msrun/test_parsing_xml_frags/parse_test.rb
|
165
|
+
- spec/ms/msrun/test_parsing_xml_frags/test_failures.rb
|
166
|
+
- spec/ms/spectrum/compare_spec.rb
|
167
|
+
- spec/ms/spectrum/filter_spec.rb
|
118
168
|
- spec/lmat_spec.rb
|
169
|
+
- spec/spec_helper.rb
|