RubyGems - mspire - Versions diffs - 0.4.9 → 0.5.0 - Mend

mspire 0.4.9 → 0.5.0

Files changed (255) hide show

data/README +27 -17
data/changelog.txt +31 -62
data/lib/ms/calc.rb +32 -0
data/lib/ms/data/interleaved.rb +60 -0
data/lib/ms/data/lazy_io.rb +73 -0
data/lib/ms/data/lazy_string.rb +15 -0
data/lib/ms/data/simple.rb +59 -0
data/lib/ms/data/transposed.rb +41 -0
data/lib/ms/data.rb +57 -0
data/lib/ms/format/format_error.rb +12 -0
data/lib/ms/spectrum.rb +25 -384
data/lib/ms/support/binary_search.rb +126 -0
data/lib/ms.rb +10 -10
metadata +38 -350
data/INSTALL +0 -58
data/README.rdoc +0 -18
data/Rakefile +0 -330
data/bin/aafreqs.rb +0 -23
data/bin/bioworks2excel.rb +0 -14
data/bin/bioworks_to_pepxml.rb +0 -148
data/bin/bioworks_to_pepxml_gui.rb +0 -225
data/bin/fasta_shaker.rb +0 -5
data/bin/filter_and_validate.rb +0 -5
data/bin/gi2annot.rb +0 -14
data/bin/id_class_anal.rb +0 -112
data/bin/id_precision.rb +0 -172
data/bin/ms_to_lmat.rb +0 -67
data/bin/pepproph_filter.rb +0 -16
data/bin/prob_validate.rb +0 -6
data/bin/protein_summary.rb +0 -6
data/bin/protxml2prots_peps.rb +0 -32
data/bin/raw_to_mzXML.rb +0 -55
data/bin/run_percolator.rb +0 -122
data/bin/sqt_group.rb +0 -26
data/bin/srf_group.rb +0 -27
data/bin/srf_to_sqt.rb +0 -40
data/lib/align/chams.rb +0 -78
data/lib/align.rb +0 -154
data/lib/archive/targz.rb +0 -94
data/lib/bsearch.rb +0 -120
data/lib/core_extensions.rb +0 -16
data/lib/fasta.rb +0 -626
data/lib/gi.rb +0 -124
data/lib/group_by.rb +0 -10
data/lib/index_by.rb +0 -11
data/lib/merge_deep.rb +0 -21
data/lib/ms/converter/mzxml.rb +0 -77
data/lib/ms/gradient_program.rb +0 -170
data/lib/ms/msrun.rb +0 -244
data/lib/ms/msrun_index.rb +0 -108
data/lib/ms/parser/mzdata/axml.rb +0 -67
data/lib/ms/parser/mzdata/dom.rb +0 -175
data/lib/ms/parser/mzdata/libxml.rb +0 -7
data/lib/ms/parser/mzdata.rb +0 -31
data/lib/ms/parser/mzxml/axml.rb +0 -70
data/lib/ms/parser/mzxml/dom.rb +0 -182
data/lib/ms/parser/mzxml/hpricot.rb +0 -253
data/lib/ms/parser/mzxml/libxml.rb +0 -19
data/lib/ms/parser/mzxml/regexp.rb +0 -122
data/lib/ms/parser/mzxml/rexml.rb +0 -72
data/lib/ms/parser/mzxml/xmlparser.rb +0 -248
data/lib/ms/parser/mzxml.rb +0 -282
data/lib/ms/parser.rb +0 -108
data/lib/ms/precursor.rb +0 -25
data/lib/ms/scan.rb +0 -81
data/lib/mspire.rb +0 -4
data/lib/pi_zero.rb +0 -244
data/lib/qvalue.rb +0 -161
data/lib/roc.rb +0 -187
data/lib/sample_enzyme.rb +0 -160
data/lib/scan_i.rb +0 -21
data/lib/spec_id/aa_freqs.rb +0 -170
data/lib/spec_id/bioworks.rb +0 -497
data/lib/spec_id/digestor.rb +0 -138
data/lib/spec_id/mass.rb +0 -179
data/lib/spec_id/parser/proph.rb +0 -335
data/lib/spec_id/precision/filter/cmdline.rb +0 -218
data/lib/spec_id/precision/filter/interactive.rb +0 -134
data/lib/spec_id/precision/filter/output.rb +0 -148
data/lib/spec_id/precision/filter.rb +0 -637
data/lib/spec_id/precision/output.rb +0 -60
data/lib/spec_id/precision/prob/cmdline.rb +0 -160
data/lib/spec_id/precision/prob/output.rb +0 -94
data/lib/spec_id/precision/prob.rb +0 -249
data/lib/spec_id/proph/pep_summary.rb +0 -104
data/lib/spec_id/proph/prot_summary.rb +0 -484
data/lib/spec_id/proph.rb +0 -4
data/lib/spec_id/protein_summary.rb +0 -489
data/lib/spec_id/sequest/params.rb +0 -316
data/lib/spec_id/sequest/pepxml.rb +0 -1458
data/lib/spec_id/sequest.rb +0 -33
data/lib/spec_id/sqt.rb +0 -349
data/lib/spec_id/srf.rb +0 -973
data/lib/spec_id.rb +0 -778
data/lib/spec_id_xml.rb +0 -99
data/lib/transmem/phobius.rb +0 -147
data/lib/transmem/toppred.rb +0 -368
data/lib/transmem.rb +0 -157
data/lib/validator/aa.rb +0 -48
data/lib/validator/aa_est.rb +0 -112
data/lib/validator/background.rb +0 -77
data/lib/validator/bias.rb +0 -95
data/lib/validator/cmdline.rb +0 -431
data/lib/validator/decoy.rb +0 -107
data/lib/validator/digestion_based.rb +0 -70
data/lib/validator/probability.rb +0 -51
data/lib/validator/prot_from_pep.rb +0 -234
data/lib/validator/q_value.rb +0 -32
data/lib/validator/transmem.rb +0 -272
data/lib/validator/true_pos.rb +0 -46
data/lib/validator.rb +0 -197
data/lib/xml.rb +0 -38
data/lib/xml_style_parser.rb +0 -119
data/lib/xmlparser_wrapper.rb +0 -19
data/release_notes.txt +0 -2
data/script/compile_and_plot_smriti_final.rb +0 -97
data/script/create_little_pepxml.rb +0 -61
data/script/degenerate_peptides.rb +0 -47
data/script/estimate_fpr_by_cysteine.rb +0 -226
data/script/extract_gradient_programs.rb +0 -56
data/script/find_cysteine_background.rb +0 -137
data/script/genuine_tps_and_probs.rb +0 -136
data/script/get_apex_values_rexml.rb +0 -44
data/script/histogram_probs.rb +0 -61
data/script/mascot_fix_pepxml.rb +0 -123
data/script/msvis.rb +0 -42
data/script/mzXML2timeIndex.rb +0 -25
data/script/peps_per_bin.rb +0 -67
data/script/prep_dir.rb +0 -121
data/script/simple_protein_digestion.rb +0 -27
data/script/smriti_final_analysis.rb +0 -103
data/script/sqt_to_meta.rb +0 -24
data/script/top_hit_per_scan.rb +0 -67
data/script/toppred_to_yaml.rb +0 -47
data/script/tpp_installer.rb +0 -249
data/specs/align_spec.rb +0 -79
data/specs/bin/bioworks_to_pepxml_spec.rb +0 -79
data/specs/bin/fasta_shaker_spec.rb +0 -259
data/specs/bin/filter_and_validate__multiple_vals_helper.yaml +0 -199
data/specs/bin/filter_and_validate_spec.rb +0 -180
data/specs/bin/ms_to_lmat_spec.rb +0 -34
data/specs/bin/prob_validate_spec.rb +0 -86
data/specs/bin/protein_summary_spec.rb +0 -14
data/specs/fasta_spec.rb +0 -354
data/specs/gi_spec.rb +0 -22
data/specs/load_bin_path.rb +0 -7
data/specs/merge_deep_spec.rb +0 -13
data/specs/ms/gradient_program_spec.rb +0 -77
data/specs/ms/msrun_spec.rb +0 -498
data/specs/ms/parser_spec.rb +0 -92
data/specs/ms/spectrum_spec.rb +0 -87
data/specs/pi_zero_spec.rb +0 -115
data/specs/qvalue_spec.rb +0 -39
data/specs/roc_spec.rb +0 -251
data/specs/rspec_autotest.rb +0 -149
data/specs/sample_enzyme_spec.rb +0 -126
data/specs/spec_helper.rb +0 -135
data/specs/spec_id/aa_freqs_spec.rb +0 -52
data/specs/spec_id/bioworks_spec.rb +0 -148
data/specs/spec_id/digestor_spec.rb +0 -75
data/specs/spec_id/precision/filter/cmdline_spec.rb +0 -20
data/specs/spec_id/precision/filter/output_spec.rb +0 -31
data/specs/spec_id/precision/filter_spec.rb +0 -246
data/specs/spec_id/precision/prob_spec.rb +0 -44
data/specs/spec_id/precision/prob_spec_helper.rb +0 -0
data/specs/spec_id/proph/pep_summary_spec.rb +0 -98
data/specs/spec_id/proph/prot_summary_spec.rb +0 -128
data/specs/spec_id/protein_summary_spec.rb +0 -189
data/specs/spec_id/sequest/params_spec.rb +0 -68
data/specs/spec_id/sequest/pepxml_spec.rb +0 -374
data/specs/spec_id/sequest_spec.rb +0 -38
data/specs/spec_id/sqt_spec.rb +0 -246
data/specs/spec_id/srf_spec.rb +0 -172
data/specs/spec_id/srf_spec_helper.rb +0 -139
data/specs/spec_id_helper.rb +0 -33
data/specs/spec_id_spec.rb +0 -366
data/specs/spec_id_xml_spec.rb +0 -33
data/specs/transmem/phobius_spec.rb +0 -425
data/specs/transmem/toppred_spec.rb +0 -298
data/specs/transmem_spec.rb +0 -60
data/specs/transmem_spec_shared.rb +0 -64
data/specs/validator/aa_est_spec.rb +0 -66
data/specs/validator/aa_spec.rb +0 -40
data/specs/validator/background_spec.rb +0 -67
data/specs/validator/bias_spec.rb +0 -122
data/specs/validator/decoy_spec.rb +0 -51
data/specs/validator/fasta_helper.rb +0 -26
data/specs/validator/prot_from_pep_spec.rb +0 -141
data/specs/validator/transmem_spec.rb +0 -146
data/specs/validator/true_pos_spec.rb +0 -58
data/specs/validator_helper.rb +0 -33
data/specs/xml_spec.rb +0 -12
data/test_files/000_pepxml18_small.xml +0 -206
data/test_files/020a.mzXML.timeIndex +0 -4710
data/test_files/4-03-03_mzXML/000.mzXML.timeIndex +0 -3973
data/test_files/4-03-03_mzXML/020.mzXML.timeIndex +0 -3872
data/test_files/4-03-03_small-prot.xml +0 -321
data/test_files/4-03-03_small.xml +0 -3876
data/test_files/7MIX_STD_110802_1.sequest_params_fragment.srf +0 -0
data/test_files/bioworks-3.3_10prots.xml +0 -5999
data/test_files/bioworks31.params +0 -77
data/test_files/bioworks32.params +0 -62
data/test_files/bioworks33.params +0 -63
data/test_files/bioworks_single_run_small.xml +0 -7237
data/test_files/bioworks_small.fasta +0 -212
data/test_files/bioworks_small.params +0 -63
data/test_files/bioworks_small.phobius +0 -109
data/test_files/bioworks_small.toppred.out +0 -2847
data/test_files/bioworks_small.xml +0 -5610
data/test_files/bioworks_with_INV_small.xml +0 -3753
data/test_files/bioworks_with_SHUFF_small.xml +0 -2503
data/test_files/corrupted_900.srf +0 -0
data/test_files/head_of_7MIX.srf +0 -0
data/test_files/interact-opd1_mods_small-prot.xml +0 -304
data/test_files/messups.fasta +0 -297
data/test_files/opd1/000.my_answer.100lines.xml +0 -101
data/test_files/opd1/000.tpp_1.2.3.first10.xml +0 -115
data/test_files/opd1/000.tpp_2.9.2.first10.xml +0 -126
data/test_files/opd1/000.v2.1.mzXML.timeIndex +0 -3748
data/test_files/opd1/000_020-prot.png +0 -0
data/test_files/opd1/000_020_3prots-prot.mod_initprob.xml +0 -62
data/test_files/opd1/000_020_3prots-prot.xml +0 -62
data/test_files/opd1/opd1_cat_inv_small-prot.xml +0 -139
data/test_files/opd1/sequest.3.1.params +0 -77
data/test_files/opd1/sequest.3.2.params +0 -62
data/test_files/opd1/twenty_scans.mzXML +0 -418
data/test_files/opd1/twenty_scans.v2.1.mzXML +0 -382
data/test_files/opd1/twenty_scans_answ.lmat +0 -0
data/test_files/opd1/twenty_scans_answ.lmata +0 -9
data/test_files/opd1_020_beginning.RAW +0 -0
data/test_files/opd1_2runs_2mods/data/020.mzData.xml +0 -683
data/test_files/opd1_2runs_2mods/data/020.readw.mzXML +0 -382
data/test_files/opd1_2runs_2mods/data/040.mzData.xml +0 -683
data/test_files/opd1_2runs_2mods/data/040.readw.mzXML +0 -382
data/test_files/opd1_2runs_2mods/data/README.txt +0 -6
data/test_files/opd1_2runs_2mods/interact-opd1_mods__small.xml +0 -753
data/test_files/orbitrap_mzData/000_cut.xml +0 -1920
data/test_files/pepproph_small.xml +0 -4691
data/test_files/phobius.small.noheader.txt +0 -50
data/test_files/phobius.small.small.txt +0 -53
data/test_files/s01_anC1_ld020mM.key.txt +0 -25
data/test_files/s01_anC1_ld020mM.meth +0 -0
data/test_files/small.fasta +0 -297
data/test_files/small.sqt +0 -87
data/test_files/smallraw.RAW +0 -0
data/test_files/tf_bioworks2excel.bioXML +0 -14340
data/test_files/tf_bioworks2excel.txt.actual +0 -1035
data/test_files/toppred.small.out +0 -416
data/test_files/toppred.xml.out +0 -318
data/test_files/validator_hits_separate/bias_bioworks_small_HS.fasta +0 -7
data/test_files/validator_hits_separate/bioworks_small_HS.xml +0 -5651
data/test_files/yeast_gly_small-prot.xml +0 -265
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data/test_files/yeast_gly_small.xml +0 -3807
data/test_files/yeast_gly_small2.parentTimes +0 -6

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