mspire 0.6.26 → 0.7.2
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- data/VERSION +1 -1
- data/lib/mspire.rb +1 -1
- data/lib/{ms → mspire}/cv.rb +1 -1
- data/lib/{ms → mspire}/cv/param.rb +5 -5
- data/lib/{ms → mspire}/cv/paramable.rb +5 -5
- data/lib/{ms → mspire}/digester.rb +2 -2
- data/lib/{ms → mspire}/error_rate/decoy.rb +1 -1
- data/lib/{ms → mspire}/error_rate/qvalue.rb +4 -4
- data/lib/{ms → mspire}/fasta.rb +5 -5
- data/lib/{ms → mspire}/ident.rb +10 -10
- data/lib/{ms → mspire}/ident/peptide.rb +3 -3
- data/lib/{ms → mspire}/ident/peptide/db.rb +12 -12
- data/lib/{ms → mspire}/ident/peptide_hit.rb +6 -6
- data/lib/{ms → mspire}/ident/peptide_hit/qvalue.rb +7 -7
- data/lib/{ms → mspire}/ident/pepxml.rb +7 -7
- data/lib/{ms → mspire}/ident/pepxml/modifications.rb +7 -7
- data/lib/{ms → mspire}/ident/pepxml/msms_pipeline_analysis.rb +6 -6
- data/lib/{ms → mspire}/ident/pepxml/msms_run_summary.rb +9 -9
- data/lib/{ms → mspire}/ident/pepxml/parameters.rb +1 -1
- data/lib/{ms → mspire}/ident/pepxml/sample_enzyme.rb +4 -4
- data/lib/{ms → mspire}/ident/pepxml/search_database.rb +5 -5
- data/lib/{ms → mspire}/ident/pepxml/search_hit.rb +4 -4
- data/lib/{ms → mspire}/ident/pepxml/search_hit/modification_info.rb +7 -7
- data/lib/{ms → mspire}/ident/pepxml/search_result.rb +5 -5
- data/lib/{ms → mspire}/ident/pepxml/search_summary.rb +12 -12
- data/lib/{ms → mspire}/ident/pepxml/spectrum_query.rb +7 -7
- data/lib/{ms → mspire}/ident/protein.rb +2 -2
- data/lib/{ms → mspire}/ident/protein_group.rb +2 -2
- data/lib/{ms → mspire}/ident/search.rb +1 -1
- data/lib/{ms → mspire}/isotope.rb +3 -3
- data/lib/{ms → mspire}/isotope/aa.rb +1 -1
- data/lib/{ms → mspire}/isotope/distribution.rb +17 -17
- data/lib/{ms → mspire}/isotope/nist_isotope_info.yml +0 -0
- data/lib/{ms → mspire}/mascot.rb +1 -1
- data/lib/{ms → mspire}/mass.rb +7 -7
- data/lib/{ms → mspire}/mass/aa.rb +6 -6
- data/lib/{ms → mspire}/molecular_formula.rb +7 -7
- data/lib/{ms → mspire}/mzml.rb +55 -55
- data/lib/{ms → mspire}/mzml/activation.rb +3 -3
- data/lib/{ms → mspire}/mzml/chromatogram.rb +3 -3
- data/lib/{ms → mspire}/mzml/chromatogram_list.rb +1 -1
- data/lib/{ms → mspire}/mzml/component.rb +5 -5
- data/lib/{ms → mspire}/mzml/contact.rb +3 -3
- data/lib/{ms → mspire}/mzml/cv.rb +1 -1
- data/lib/{ms → mspire}/mzml/data_array.rb +12 -12
- data/lib/{ms → mspire}/mzml/data_array_container_like.rb +7 -7
- data/lib/{ms → mspire}/mzml/data_processing.rb +3 -3
- data/lib/{ms → mspire}/mzml/file_content.rb +3 -3
- data/lib/{ms → mspire}/mzml/file_description.rb +4 -4
- data/lib/{ms → mspire}/mzml/index_list.rb +2 -2
- data/lib/{ms → mspire}/mzml/instrument_configuration.rb +7 -7
- data/lib/{ms → mspire}/mzml/isolation_window.rb +3 -3
- data/lib/{ms → mspire}/mzml/list.rb +1 -1
- data/lib/{ms → mspire}/mzml/plms1.rb +3 -3
- data/lib/{ms → mspire}/mzml/precursor.rb +6 -6
- data/lib/{ms → mspire}/mzml/processing_method.rb +3 -3
- data/lib/{ms → mspire}/mzml/product.rb +3 -3
- data/lib/{ms → mspire}/mzml/referenceable_param_group.rb +4 -4
- data/lib/{ms → mspire}/mzml/run.rb +3 -3
- data/lib/{ms → mspire}/mzml/sample.rb +5 -5
- data/lib/{ms → mspire}/mzml/scan.rb +4 -4
- data/lib/{ms → mspire}/mzml/scan_list.rb +3 -3
- data/lib/{ms → mspire}/mzml/scan_settings.rb +5 -5
- data/lib/{ms → mspire}/mzml/selected_ion.rb +5 -5
- data/lib/{ms → mspire}/mzml/software.rb +5 -5
- data/lib/{ms → mspire}/mzml/source_file.rb +5 -5
- data/lib/{ms → mspire}/mzml/spectrum.rb +33 -20
- data/lib/{ms → mspire}/mzml/spectrum_list.rb +4 -4
- data/lib/{ms → mspire}/obo.rb +1 -1
- data/lib/{ms → mspire}/peak.rb +3 -3
- data/lib/{ms → mspire}/peak/point.rb +1 -1
- data/lib/{ms → mspire}/plms1.rb +4 -4
- data/lib/{ms → mspire}/quant/qspec.rb +4 -4
- data/lib/{ms → mspire}/quant/qspec/protein_group_comparison.rb +4 -4
- data/lib/{ms → mspire}/spectrum.rb +6 -6
- data/lib/{ms → mspire}/spectrum/centroid.rb +1 -1
- data/lib/{ms → mspire}/spectrum_like.rb +5 -5
- data/lib/{ms → mspire}/user_param.rb +2 -2
- data/script/mzml_read_binary.rb +1 -1
- data/spec/{ms → mspire}/cv/param_spec.rb +6 -6
- data/spec/{ms → mspire}/digester_spec.rb +10 -10
- data/spec/{ms → mspire}/error_rate/qvalue_spec.rb +3 -3
- data/spec/{ms → mspire}/fasta_spec.rb +10 -10
- data/spec/{ms → mspire}/ident/peptide/db_spec.rb +9 -9
- data/spec/{ms → mspire}/ident/pepxml/sample_enzyme_spec.rb +10 -10
- data/spec/{ms → mspire}/ident/pepxml/search_hit/modification_info_spec.rb +4 -4
- data/spec/{ms → mspire}/ident/pepxml_spec.rb +22 -22
- data/spec/{ms → mspire}/ident/protein_group_spec.rb +4 -4
- data/spec/{ms → mspire}/isotope/aa_spec.rb +3 -3
- data/spec/{ms → mspire}/isotope/distribution_spec.rb +4 -4
- data/spec/{ms → mspire}/isotope_spec.rb +9 -9
- data/spec/{ms → mspire}/mass_spec.rb +8 -8
- data/spec/{ms → mspire}/molecular_formula_spec.rb +4 -4
- data/spec/{ms → mspire}/mzml/cv_spec.rb +4 -4
- data/spec/{ms → mspire}/mzml/data_array_spec.rb +7 -7
- data/spec/{ms → mspire}/mzml/file_content_spec.rb +4 -4
- data/spec/{ms → mspire}/mzml/file_description_spec.rb +4 -4
- data/spec/{ms → mspire}/mzml/index_list_spec.rb +13 -13
- data/spec/{ms → mspire}/mzml/plms1_spec.rb +8 -8
- data/spec/{ms → mspire}/mzml/referenceable_param_group_spec.rb +6 -6
- data/spec/{ms → mspire}/mzml_spec.rb +30 -30
- data/spec/{ms → mspire}/peak_spec.rb +10 -10
- data/spec/{ms → mspire}/plms1_spec.rb +7 -7
- data/spec/{ms → mspire}/quant/qspec_spec.rb +2 -2
- data/spec/{ms → mspire}/spectrum_spec.rb +8 -8
- data/spec/{ms → mspire}/user_param_spec.rb +8 -8
- data/spec/testfiles/{ms → mspire}/ident/peptide/db/uni_11_sp_tr.fasta +0 -0
- data/spec/testfiles/{ms → mspire}/ident/peptide/db/uni_11_sp_tr.msd_clvg2.min_aaseq4.yml +0 -0
- data/spec/testfiles/{ms → mspire}/mzml/j24z.idx_comp.3.mzML +0 -0
- data/spec/testfiles/{ms → mspire}/mzml/mspire_simulated.MSn.check.mzML +0 -0
- data/spec/testfiles/{ms → mspire}/mzml/openms.noidx_nocomp.12.mzML +0 -0
- data/spec/testfiles/{ms → mspire}/quant/kill_extra_tabs.rb +0 -0
- data/spec/testfiles/{ms → mspire}/quant/max_quant_output.provenance.txt +0 -0
- data/spec/testfiles/{ms → mspire}/quant/max_quant_output.txt +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_final.killedextratabs.tsv +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_final.killedextratabs.tsv_qspecgp +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_final.killedextratabs.tsv_qspecgp.csv +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_final.txt +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_final.txt_qspecgp +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_lfq_qspec.CSV.csv +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_lfq_qspec.csv +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_lfq_qspec.oneprot.csv +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_lfq_qspec.oneprot.tsv +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_lfq_qspec.oneprot.tsv_qspecgp +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_lfq_qspec.oneprot.tsv_qspecgp.csv +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_lfq_qspec.txt +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_lfq_tabdel.txt +0 -0
- data/spec/testfiles/{ms → mspire}/quant/pdcd5_lfq_tabdel.txt_qspecgp +0 -0
- data/spec/testfiles/{ms → mspire}/quant/remove_rest_of_proteins.rb +0 -0
- data/spec/testfiles/{ms → mspire}/quant/unlog_transform.rb +0 -0
- metadata +148 -194
- data/lib/ms.rb +0 -3
@@ -1,22 +1,22 @@
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require 'spec_helper'
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-
require '
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require '
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+
require 'mspire/user_param'
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require 'mspire/cv/param'
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-
describe
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describe Mspire::UserParam do
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describe 'initializing with various args' do
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it 'can be initialized with the name' do
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arg = 'special_user_param'
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param =
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param = Mspire::UserParam.new arg
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param.name.should == arg
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param.unit.should be_nil
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end
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it' can be initialized with an included UO accession' do
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arg = 'special_user_param'
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param =
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param = Mspire::UserParam.new arg, 'UO:0000108'
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param.name.should == arg
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param.unit.should_not be_nil
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param.unit.accession.should == 'UO:0000108'
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@@ -24,7 +24,7 @@ describe MS::UserParam do
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it' can be initialized with an included CV::Param (unit)' do
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arg = 'special_user_param'
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param =
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param = Mspire::UserParam.new arg, Mspire::CV::Param['UO:0000108']
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param.name.should == arg
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param.unit.should_not be_nil
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param.unit.accession.should == 'UO:0000108'
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@@ -32,14 +32,14 @@ describe MS::UserParam do
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it 'can be initialized with a name and value (and type)' do
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args = %w(some_user_param 88 xsd:float)
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param =
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param = Mspire::UserParam.new *args
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param.name.should == args[0]
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param.value.should == args[1]
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param.type.should == args[2]
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param.unit.should be_nil
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args = %w(some_user_param 88 xsd:float UO:0000108)
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param =
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param = Mspire::UserParam.new *args
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param.name.should == args[0]
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param.value.should == args[1]
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param.type.should == args[2]
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metadata
CHANGED
@@ -1,7 +1,7 @@
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--- !ruby/object:Gem::Specification
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name: mspire
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version: !ruby/object:Gem::Version
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version: 0.
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version: 0.7.2
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prerelease:
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platform: ruby
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authors:
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@@ -10,11 +10,11 @@ authors:
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autorequire:
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bindir: bin
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cert_chain: []
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date: 2012-03-
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date: 2012-03-16 00:00:00.000000000 Z
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dependencies:
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- !ruby/object:Gem::Dependency
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name: nokogiri
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requirement: !ruby/object:Gem::Requirement
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requirement: &19248100 !ruby/object:Gem::Requirement
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none: false
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requirements:
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- - ~>
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@@ -22,15 +22,10 @@ dependencies:
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version: '1.5'
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type: :runtime
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prerelease: false
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version_requirements:
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none: false
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requirements:
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-
- - ~>
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-
- !ruby/object:Gem::Version
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version: '1.5'
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version_requirements: *19248100
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26
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- !ruby/object:Gem::Dependency
|
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name: bsearch
|
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requirement: !ruby/object:Gem::Requirement
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requirement: &19245800 !ruby/object:Gem::Requirement
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none: false
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requirements:
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- - ! '>='
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@@ -38,15 +33,10 @@ dependencies:
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version: 1.5.0
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type: :runtime
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prerelease: false
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version_requirements:
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none: false
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requirements:
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-
- - ! '>='
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-
- !ruby/object:Gem::Version
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version: 1.5.0
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version_requirements: *19245800
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- !ruby/object:Gem::Dependency
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name: andand
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requirement: !ruby/object:Gem::Requirement
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requirement: &19243220 !ruby/object:Gem::Requirement
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none: false
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requirements:
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- - ! '>='
|
@@ -54,15 +44,10 @@ dependencies:
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version: 1.3.1
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type: :runtime
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prerelease: false
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version_requirements:
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none: false
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requirements:
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-
- - ! '>='
|
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- !ruby/object:Gem::Version
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version: 1.3.1
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version_requirements: *19243220
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- !ruby/object:Gem::Dependency
|
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name: obo
|
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requirement: !ruby/object:Gem::Requirement
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requirement: &19629860 !ruby/object:Gem::Requirement
|
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none: false
|
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requirements:
|
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- - ! '>='
|
@@ -70,15 +55,10 @@ dependencies:
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version: 0.1.0
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type: :runtime
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prerelease: false
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version_requirements:
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none: false
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requirements:
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-
- - ! '>='
|
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- !ruby/object:Gem::Version
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version: 0.1.0
|
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version_requirements: *19629860
|
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- !ruby/object:Gem::Dependency
|
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name: builder
|
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requirement: !ruby/object:Gem::Requirement
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requirement: &19626740 !ruby/object:Gem::Requirement
|
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none: false
|
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requirements:
|
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- - ! '>='
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@@ -86,15 +66,10 @@ dependencies:
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66
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version: 3.0.0
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type: :runtime
|
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prerelease: false
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version_requirements:
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none: false
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requirements:
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-
- - ! '>='
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- !ruby/object:Gem::Version
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94
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-
version: 3.0.0
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version_requirements: *19626740
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- !ruby/object:Gem::Dependency
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name: trollop
|
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requirement: !ruby/object:Gem::Requirement
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requirement: &19624700 !ruby/object:Gem::Requirement
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none: false
|
99
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requirements:
|
100
75
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- - ! '>='
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@@ -102,15 +77,10 @@ dependencies:
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102
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version: 1.16.2
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type: :runtime
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prerelease: false
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version_requirements:
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none: false
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requirements:
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-
- - ! '>='
|
109
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-
- !ruby/object:Gem::Version
|
110
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-
version: 1.16.2
|
80
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version_requirements: *19624700
|
111
81
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- !ruby/object:Gem::Dependency
|
112
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name: rspec
|
113
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requirement: !ruby/object:Gem::Requirement
|
83
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requirement: &19713620 !ruby/object:Gem::Requirement
|
114
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none: false
|
115
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requirements:
|
116
86
|
- - ~>
|
@@ -118,15 +88,10 @@ dependencies:
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88
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version: '2.6'
|
119
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type: :development
|
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90
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prerelease: false
|
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version_requirements:
|
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none: false
|
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requirements:
|
124
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-
- - ~>
|
125
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-
- !ruby/object:Gem::Version
|
126
|
-
version: '2.6'
|
91
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version_requirements: *19713620
|
127
92
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- !ruby/object:Gem::Dependency
|
128
93
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name: jeweler
|
129
|
-
requirement: !ruby/object:Gem::Requirement
|
94
|
+
requirement: &19712460 !ruby/object:Gem::Requirement
|
130
95
|
none: false
|
131
96
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requirements:
|
132
97
|
- - ~>
|
@@ -134,15 +99,10 @@ dependencies:
|
|
134
99
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version: 1.5.2
|
135
100
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type: :development
|
136
101
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prerelease: false
|
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version_requirements:
|
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none: false
|
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requirements:
|
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|
-
- - ~>
|
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-
- !ruby/object:Gem::Version
|
142
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-
version: 1.5.2
|
102
|
+
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