mspire 0.4.7 → 0.4.9
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- data/changelog.txt +4 -0
- data/lib/mspire.rb +1 -1
- data/lib/spec_id/sequest/pepxml.rb +2 -2
- data/lib/spec_id/srf.rb +0 -1
- data/lib/validator/transmem.rb +1 -1
- metadata +223 -249
data/changelog.txt
CHANGED
@@ -221,3 +221,7 @@ filter)
|
|
221
221
|
## version 0.4.7
|
222
222
|
1. Added ability to quickly grab sequest params out of a .SRF file
|
223
223
|
2. Added helpful runtime error if print_duplicate_references is 0.
|
224
|
+
|
225
|
+
## version 0.4.9
|
226
|
+
1. quiet some unneeded output and fixed truncation of filenames with '.'
|
227
|
+
inside them.
|
data/lib/mspire.rb
CHANGED
@@ -767,8 +767,8 @@ Default_Options = {
|
|
767
767
|
# given any kind of filename (from windows or whatever)
|
768
768
|
# returns the base of the filename with no file extension
|
769
769
|
def self.base_name_noext(file)
|
770
|
-
file.
|
771
|
-
|
770
|
+
basename = file.split(/[\/\\]/).last
|
771
|
+
basename.chomp(File.extname(basename))
|
772
772
|
end
|
773
773
|
|
774
774
|
|
data/lib/spec_id/srf.rb
CHANGED
@@ -853,7 +853,6 @@ class SRF::OUT::Pep
|
|
853
853
|
end
|
854
854
|
|
855
855
|
def self.read_extra_references(fh, num_extra_references, pep_hits, global_ref_hash)
|
856
|
-
p num_extra_references
|
857
856
|
num_extra_references.times do
|
858
857
|
# 80 bytes total (with index number)
|
859
858
|
pep = pep_hits[fh.read(8).unpack('x4I').first - 1]
|
data/lib/validator/transmem.rb
CHANGED
@@ -136,7 +136,7 @@ class Validator::Transmem::Protein < Validator::DigestionBased
|
|
136
136
|
prts = pep.prots
|
137
137
|
prts_w_keys = 0
|
138
138
|
sum_of_fractions = 0.0
|
139
|
-
prts.each do |prot|
|
139
|
+
prts.each do |prot|
|
140
140
|
key = @transmem_index.reference_to_key(prot.reference)
|
141
141
|
ans = @transmem_index.avg_overlap(key, pep.aaseq, :fraction)
|
142
142
|
if ans
|
metadata
CHANGED
@@ -1,7 +1,7 @@
|
|
1
1
|
--- !ruby/object:Gem::Specification
|
2
2
|
name: mspire
|
3
3
|
version: !ruby/object:Gem::Version
|
4
|
-
version: 0.4.
|
4
|
+
version: 0.4.9
|
5
5
|
platform: ruby
|
6
6
|
authors:
|
7
7
|
- John Prince
|
@@ -9,11 +9,12 @@ autorequire:
|
|
9
9
|
bindir: bin
|
10
10
|
cert_chain: []
|
11
11
|
|
12
|
-
date:
|
12
|
+
date: 2010-01-06 00:00:00 -07:00
|
13
13
|
default_executable:
|
14
14
|
dependencies:
|
15
15
|
- !ruby/object:Gem::Dependency
|
16
16
|
name: libjtp
|
17
|
+
type: :runtime
|
17
18
|
version_requirement:
|
18
19
|
version_requirements: !ruby/object:Gem::Requirement
|
19
20
|
requirements:
|
@@ -23,6 +24,7 @@ dependencies:
|
|
23
24
|
version:
|
24
25
|
- !ruby/object:Gem::Dependency
|
25
26
|
name: axml
|
27
|
+
type: :runtime
|
26
28
|
version_requirement:
|
27
29
|
version_requirements: !ruby/object:Gem::Requirement
|
28
30
|
requirements:
|
@@ -32,6 +34,7 @@ dependencies:
|
|
32
34
|
version:
|
33
35
|
- !ruby/object:Gem::Dependency
|
34
36
|
name: arrayclass
|
37
|
+
type: :runtime
|
35
38
|
version_requirement:
|
36
39
|
version_requirements: !ruby/object:Gem::Requirement
|
37
40
|
requirements:
|
@@ -42,25 +45,25 @@ dependencies:
|
|
42
45
|
description: mspire is for working with mass spectrometry proteomics data
|
43
46
|
email: jprince@icmb.utexas.edu
|
44
47
|
executables:
|
45
|
-
-
|
46
|
-
-
|
47
|
-
-
|
48
|
-
- raw_to_mzXML.rb
|
49
|
-
- run_percolator.rb
|
48
|
+
- bioworks2excel.rb
|
49
|
+
- protein_summary.rb
|
50
|
+
- fasta_shaker.rb
|
50
51
|
- srf_to_sqt.rb
|
51
|
-
-
|
52
|
+
- pepproph_filter.rb
|
53
|
+
- raw_to_mzXML.rb
|
54
|
+
- sqt_group.rb
|
52
55
|
- srf_group.rb
|
53
|
-
- ms_to_lmat.rb
|
54
|
-
- protein_summary.rb
|
55
56
|
- bioworks_to_pepxml_gui.rb
|
56
57
|
- id_class_anal.rb
|
58
|
+
- bioworks_to_pepxml.rb
|
59
|
+
- run_percolator.rb
|
60
|
+
- gi2annot.rb
|
57
61
|
- id_precision.rb
|
58
|
-
-
|
62
|
+
- filter_and_validate.rb
|
59
63
|
- aafreqs.rb
|
60
|
-
-
|
61
|
-
-
|
62
|
-
-
|
63
|
-
- fasta_shaker.rb
|
64
|
+
- ms_to_lmat.rb
|
65
|
+
- protxml2prots_peps.rb
|
66
|
+
- prob_validate.rb
|
64
67
|
extensions: []
|
65
68
|
|
66
69
|
extra_rdoc_files:
|
@@ -73,278 +76,249 @@ files:
|
|
73
76
|
- LICENSE
|
74
77
|
- changelog.txt
|
75
78
|
- release_notes.txt
|
76
|
-
- lib/ms
|
77
|
-
- lib/ms/parser
|
78
|
-
- lib/ms/parser/mzxml
|
79
|
-
- lib/ms/parser/mzxml/rexml.rb
|
80
|
-
- lib/ms/parser/mzxml/libxml.rb
|
81
|
-
- lib/ms/parser/mzxml/xmlparser.rb
|
82
|
-
- lib/ms/parser/mzxml/regexp.rb
|
83
|
-
- lib/ms/parser/mzxml/axml.rb
|
84
|
-
- lib/ms/parser/mzxml/hpricot.rb
|
85
|
-
- lib/ms/parser/mzxml/dom.rb
|
86
|
-
- lib/ms/parser/mzdata
|
87
|
-
- lib/ms/parser/mzdata/libxml.rb
|
79
|
+
- lib/ms/parser/mzdata.rb
|
88
80
|
- lib/ms/parser/mzdata/axml.rb
|
81
|
+
- lib/ms/parser/mzdata/libxml.rb
|
89
82
|
- lib/ms/parser/mzdata/dom.rb
|
90
|
-
- lib/ms/parser/mzdata.rb
|
91
83
|
- lib/ms/parser/mzxml.rb
|
84
|
+
- lib/ms/parser/mzxml/axml.rb
|
85
|
+
- lib/ms/parser/mzxml/hpricot.rb
|
86
|
+
- lib/ms/parser/mzxml/libxml.rb
|
87
|
+
- lib/ms/parser/mzxml/dom.rb
|
88
|
+
- lib/ms/parser/mzxml/regexp.rb
|
89
|
+
- lib/ms/parser/mzxml/rexml.rb
|
90
|
+
- lib/ms/parser/mzxml/xmlparser.rb
|
91
|
+
- lib/ms/spectrum.rb
|
92
92
|
- lib/ms/msrun.rb
|
93
|
-
- lib/ms/gradient_program.rb
|
94
|
-
- lib/ms/precursor.rb
|
95
|
-
- lib/ms/msrun_index.rb
|
96
93
|
- lib/ms/parser.rb
|
97
|
-
- lib/ms/
|
98
|
-
- lib/ms/converter
|
94
|
+
- lib/ms/msrun_index.rb
|
99
95
|
- lib/ms/converter/mzxml.rb
|
100
96
|
- lib/ms/scan.rb
|
101
|
-
- lib/
|
102
|
-
- lib/
|
103
|
-
- lib/
|
104
|
-
- lib/qvalue.rb
|
105
|
-
- lib/roc.rb
|
106
|
-
- lib/spec_id.rb
|
107
|
-
- lib/xml.rb
|
97
|
+
- lib/ms/precursor.rb
|
98
|
+
- lib/ms/gradient_program.rb
|
99
|
+
- lib/align/chams.rb
|
108
100
|
- lib/group_by.rb
|
109
|
-
- lib/
|
110
|
-
- lib/
|
111
|
-
- lib/transmem
|
112
|
-
- lib/transmem/phobius.rb
|
113
|
-
- lib/transmem/toppred.rb
|
114
|
-
- lib/ms.rb
|
115
|
-
- lib/pi_zero.rb
|
116
|
-
- lib/spec_id
|
117
|
-
- lib/spec_id/srf.rb
|
118
|
-
- lib/spec_id/sequest.rb
|
119
|
-
- lib/spec_id/parser
|
101
|
+
- lib/mspire.rb
|
102
|
+
- lib/spec_id/protein_summary.rb
|
120
103
|
- lib/spec_id/parser/proph.rb
|
121
|
-
- lib/spec_id/
|
122
|
-
- lib/spec_id/
|
123
|
-
- lib/spec_id/
|
124
|
-
- lib/spec_id/
|
125
|
-
- lib/spec_id/precision/filter.rb
|
126
|
-
- lib/spec_id/precision/prob.rb
|
127
|
-
- lib/spec_id/precision/output.rb
|
128
|
-
- lib/spec_id/precision/filter
|
129
|
-
- lib/spec_id/precision/filter/interactive.rb
|
104
|
+
- lib/spec_id/mass.rb
|
105
|
+
- lib/spec_id/srf.rb
|
106
|
+
- lib/spec_id/proph/prot_summary.rb
|
107
|
+
- lib/spec_id/proph/pep_summary.rb
|
130
108
|
- lib/spec_id/precision/filter/cmdline.rb
|
109
|
+
- lib/spec_id/precision/filter/interactive.rb
|
131
110
|
- lib/spec_id/precision/filter/output.rb
|
132
|
-
- lib/spec_id/precision/prob
|
133
111
|
- lib/spec_id/precision/prob/cmdline.rb
|
134
112
|
- lib/spec_id/precision/prob/output.rb
|
135
|
-
- lib/spec_id/
|
136
|
-
- lib/spec_id/
|
137
|
-
- lib/spec_id/
|
138
|
-
- lib/spec_id/proph/prot_summary.rb
|
139
|
-
- lib/spec_id/protein_summary.rb
|
113
|
+
- lib/spec_id/precision/prob.rb
|
114
|
+
- lib/spec_id/precision/output.rb
|
115
|
+
- lib/spec_id/precision/filter.rb
|
140
116
|
- lib/spec_id/proph.rb
|
141
|
-
- lib/spec_id/
|
117
|
+
- lib/spec_id/bioworks.rb
|
118
|
+
- lib/spec_id/sequest/params.rb
|
119
|
+
- lib/spec_id/sequest/pepxml.rb
|
142
120
|
- lib/spec_id/digestor.rb
|
121
|
+
- lib/spec_id/sequest.rb
|
143
122
|
- lib/spec_id/sqt.rb
|
144
|
-
- lib/spec_id/
|
145
|
-
- lib/
|
123
|
+
- lib/spec_id/aa_freqs.rb
|
124
|
+
- lib/pi_zero.rb
|
146
125
|
- lib/align.rb
|
126
|
+
- lib/scan_i.rb
|
127
|
+
- lib/validator.rb
|
128
|
+
- lib/spec_id.rb
|
129
|
+
- lib/archive/targz.rb
|
130
|
+
- lib/qvalue.rb
|
131
|
+
- lib/ms.rb
|
132
|
+
- lib/core_extensions.rb
|
133
|
+
- lib/bsearch.rb
|
134
|
+
- lib/roc.rb
|
135
|
+
- lib/sample_enzyme.rb
|
136
|
+
- lib/spec_id_xml.rb
|
147
137
|
- lib/xmlparser_wrapper.rb
|
138
|
+
- lib/fasta.rb
|
139
|
+
- lib/transmem/toppred.rb
|
140
|
+
- lib/transmem/phobius.rb
|
141
|
+
- lib/index_by.rb
|
148
142
|
- lib/transmem.rb
|
149
|
-
- lib/align
|
150
|
-
- lib/align/chams.rb
|
151
|
-
- lib/validator.rb
|
152
143
|
- lib/gi.rb
|
153
|
-
- lib/
|
154
|
-
- lib/
|
155
|
-
- lib/validator/
|
156
|
-
- lib/validator/decoy.rb
|
157
|
-
- lib/validator/true_pos.rb
|
144
|
+
- lib/xml_style_parser.rb
|
145
|
+
- lib/merge_deep.rb
|
146
|
+
- lib/validator/bias.rb
|
158
147
|
- lib/validator/aa_est.rb
|
159
|
-
- lib/validator/probability.rb
|
160
148
|
- lib/validator/cmdline.rb
|
161
|
-
- lib/validator/digestion_based.rb
|
162
|
-
- lib/validator/transmem.rb
|
163
|
-
- lib/validator/bias.rb
|
164
149
|
- lib/validator/background.rb
|
150
|
+
- lib/validator/digestion_based.rb
|
151
|
+
- lib/validator/decoy.rb
|
152
|
+
- lib/validator/true_pos.rb
|
153
|
+
- lib/validator/aa.rb
|
165
154
|
- lib/validator/q_value.rb
|
166
|
-
- lib/
|
167
|
-
- lib/
|
168
|
-
- lib/
|
169
|
-
- lib/
|
170
|
-
-
|
171
|
-
-
|
172
|
-
- bin/
|
173
|
-
- bin/protxml2prots_peps.rb
|
174
|
-
- bin/filter_and_validate.rb
|
175
|
-
- bin/raw_to_mzXML.rb
|
176
|
-
- bin/run_percolator.rb
|
155
|
+
- lib/validator/probability.rb
|
156
|
+
- lib/validator/transmem.rb
|
157
|
+
- lib/validator/prot_from_pep.rb
|
158
|
+
- lib/xml.rb
|
159
|
+
- bin/bioworks2excel.rb
|
160
|
+
- bin/protein_summary.rb
|
161
|
+
- bin/fasta_shaker.rb
|
177
162
|
- bin/srf_to_sqt.rb
|
178
|
-
- bin/
|
163
|
+
- bin/pepproph_filter.rb
|
164
|
+
- bin/raw_to_mzXML.rb
|
165
|
+
- bin/sqt_group.rb
|
179
166
|
- bin/srf_group.rb
|
180
|
-
- bin/ms_to_lmat.rb
|
181
|
-
- bin/protein_summary.rb
|
182
167
|
- bin/bioworks_to_pepxml_gui.rb
|
183
168
|
- bin/id_class_anal.rb
|
169
|
+
- bin/bioworks_to_pepxml.rb
|
170
|
+
- bin/run_percolator.rb
|
171
|
+
- bin/gi2annot.rb
|
184
172
|
- bin/id_precision.rb
|
185
|
-
- bin/
|
173
|
+
- bin/filter_and_validate.rb
|
186
174
|
- bin/aafreqs.rb
|
187
|
-
- bin/
|
188
|
-
- bin/
|
189
|
-
- bin/
|
190
|
-
-
|
191
|
-
- script/estimate_fpr_by_cysteine.rb
|
192
|
-
- script/toppred_to_yaml.rb
|
175
|
+
- bin/ms_to_lmat.rb
|
176
|
+
- bin/protxml2prots_peps.rb
|
177
|
+
- bin/prob_validate.rb
|
178
|
+
- script/mascot_fix_pepxml.rb
|
193
179
|
- script/extract_gradient_programs.rb
|
194
|
-
- script/
|
195
|
-
- script/genuine_tps_and_probs.rb
|
196
|
-
- script/histogram_probs.rb
|
197
|
-
- script/find_cysteine_background.rb
|
198
|
-
- script/degenerate_peptides.rb
|
180
|
+
- script/smriti_final_analysis.rb
|
199
181
|
- script/prep_dir.rb
|
182
|
+
- script/toppred_to_yaml.rb
|
183
|
+
- script/sqt_to_meta.rb
|
200
184
|
- script/compile_and_plot_smriti_final.rb
|
201
|
-
- script/
|
202
|
-
- script/
|
185
|
+
- script/find_cysteine_background.rb
|
186
|
+
- script/estimate_fpr_by_cysteine.rb
|
203
187
|
- script/top_hit_per_scan.rb
|
204
|
-
- script/create_little_pepxml.rb
|
205
|
-
- script/smriti_final_analysis.rb
|
206
|
-
- script/get_apex_values_rexml.rb
|
207
|
-
- script/sqt_to_meta.rb
|
208
188
|
- script/msvis.rb
|
189
|
+
- script/histogram_probs.rb
|
190
|
+
- script/genuine_tps_and_probs.rb
|
191
|
+
- script/get_apex_values_rexml.rb
|
209
192
|
- script/simple_protein_digestion.rb
|
193
|
+
- script/mzXML2timeIndex.rb
|
210
194
|
- script/peps_per_bin.rb
|
211
|
-
-
|
212
|
-
-
|
195
|
+
- script/tpp_installer.rb
|
196
|
+
- script/degenerate_peptides.rb
|
197
|
+
- script/create_little_pepxml.rb
|
198
|
+
- specs/ms/msrun_spec.rb
|
213
199
|
- specs/ms/parser_spec.rb
|
214
200
|
- specs/ms/spectrum_spec.rb
|
215
|
-
- specs/ms/
|
216
|
-
- specs/
|
217
|
-
- specs/qvalue_spec.rb
|
218
|
-
- specs/spec_helper.rb
|
219
|
-
- specs/fasta_spec.rb
|
220
|
-
- specs/transmem
|
221
|
-
- specs/transmem/phobius_spec.rb
|
222
|
-
- specs/transmem/toppred_spec.rb
|
223
|
-
- specs/align_spec.rb
|
224
|
-
- specs/spec_id_helper.rb
|
225
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