mspire 0.4.9 → 0.5.0

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Files changed (255) hide show
  1. data/README +27 -17
  2. data/changelog.txt +31 -62
  3. data/lib/ms/calc.rb +32 -0
  4. data/lib/ms/data/interleaved.rb +60 -0
  5. data/lib/ms/data/lazy_io.rb +73 -0
  6. data/lib/ms/data/lazy_string.rb +15 -0
  7. data/lib/ms/data/simple.rb +59 -0
  8. data/lib/ms/data/transposed.rb +41 -0
  9. data/lib/ms/data.rb +57 -0
  10. data/lib/ms/format/format_error.rb +12 -0
  11. data/lib/ms/spectrum.rb +25 -384
  12. data/lib/ms/support/binary_search.rb +126 -0
  13. data/lib/ms.rb +10 -10
  14. metadata +38 -350
  15. data/INSTALL +0 -58
  16. data/README.rdoc +0 -18
  17. data/Rakefile +0 -330
  18. data/bin/aafreqs.rb +0 -23
  19. data/bin/bioworks2excel.rb +0 -14
  20. data/bin/bioworks_to_pepxml.rb +0 -148
  21. data/bin/bioworks_to_pepxml_gui.rb +0 -225
  22. data/bin/fasta_shaker.rb +0 -5
  23. data/bin/filter_and_validate.rb +0 -5
  24. data/bin/gi2annot.rb +0 -14
  25. data/bin/id_class_anal.rb +0 -112
  26. data/bin/id_precision.rb +0 -172
  27. data/bin/ms_to_lmat.rb +0 -67
  28. data/bin/pepproph_filter.rb +0 -16
  29. data/bin/prob_validate.rb +0 -6
  30. data/bin/protein_summary.rb +0 -6
  31. data/bin/protxml2prots_peps.rb +0 -32
  32. data/bin/raw_to_mzXML.rb +0 -55
  33. data/bin/run_percolator.rb +0 -122
  34. data/bin/sqt_group.rb +0 -26
  35. data/bin/srf_group.rb +0 -27
  36. data/bin/srf_to_sqt.rb +0 -40
  37. data/lib/align/chams.rb +0 -78
  38. data/lib/align.rb +0 -154
  39. data/lib/archive/targz.rb +0 -94
  40. data/lib/bsearch.rb +0 -120
  41. data/lib/core_extensions.rb +0 -16
  42. data/lib/fasta.rb +0 -626
  43. data/lib/gi.rb +0 -124
  44. data/lib/group_by.rb +0 -10
  45. data/lib/index_by.rb +0 -11
  46. data/lib/merge_deep.rb +0 -21
  47. data/lib/ms/converter/mzxml.rb +0 -77
  48. data/lib/ms/gradient_program.rb +0 -170
  49. data/lib/ms/msrun.rb +0 -244
  50. data/lib/ms/msrun_index.rb +0 -108
  51. data/lib/ms/parser/mzdata/axml.rb +0 -67
  52. data/lib/ms/parser/mzdata/dom.rb +0 -175
  53. data/lib/ms/parser/mzdata/libxml.rb +0 -7
  54. data/lib/ms/parser/mzdata.rb +0 -31
  55. data/lib/ms/parser/mzxml/axml.rb +0 -70
  56. data/lib/ms/parser/mzxml/dom.rb +0 -182
  57. data/lib/ms/parser/mzxml/hpricot.rb +0 -253
  58. data/lib/ms/parser/mzxml/libxml.rb +0 -19
  59. data/lib/ms/parser/mzxml/regexp.rb +0 -122
  60. data/lib/ms/parser/mzxml/rexml.rb +0 -72
  61. data/lib/ms/parser/mzxml/xmlparser.rb +0 -248
  62. data/lib/ms/parser/mzxml.rb +0 -282
  63. data/lib/ms/parser.rb +0 -108
  64. data/lib/ms/precursor.rb +0 -25
  65. data/lib/ms/scan.rb +0 -81
  66. data/lib/mspire.rb +0 -4
  67. data/lib/pi_zero.rb +0 -244
  68. data/lib/qvalue.rb +0 -161
  69. data/lib/roc.rb +0 -187
  70. data/lib/sample_enzyme.rb +0 -160
  71. data/lib/scan_i.rb +0 -21
  72. data/lib/spec_id/aa_freqs.rb +0 -170
  73. data/lib/spec_id/bioworks.rb +0 -497
  74. data/lib/spec_id/digestor.rb +0 -138
  75. data/lib/spec_id/mass.rb +0 -179
  76. data/lib/spec_id/parser/proph.rb +0 -335
  77. data/lib/spec_id/precision/filter/cmdline.rb +0 -218
  78. data/lib/spec_id/precision/filter/interactive.rb +0 -134
  79. data/lib/spec_id/precision/filter/output.rb +0 -148
  80. data/lib/spec_id/precision/filter.rb +0 -637
  81. data/lib/spec_id/precision/output.rb +0 -60
  82. data/lib/spec_id/precision/prob/cmdline.rb +0 -160
  83. data/lib/spec_id/precision/prob/output.rb +0 -94
  84. data/lib/spec_id/precision/prob.rb +0 -249
  85. data/lib/spec_id/proph/pep_summary.rb +0 -104
  86. data/lib/spec_id/proph/prot_summary.rb +0 -484
  87. data/lib/spec_id/proph.rb +0 -4
  88. data/lib/spec_id/protein_summary.rb +0 -489
  89. data/lib/spec_id/sequest/params.rb +0 -316
  90. data/lib/spec_id/sequest/pepxml.rb +0 -1458
  91. data/lib/spec_id/sequest.rb +0 -33
  92. data/lib/spec_id/sqt.rb +0 -349
  93. data/lib/spec_id/srf.rb +0 -973
  94. data/lib/spec_id.rb +0 -778
  95. data/lib/spec_id_xml.rb +0 -99
  96. data/lib/transmem/phobius.rb +0 -147
  97. data/lib/transmem/toppred.rb +0 -368
  98. data/lib/transmem.rb +0 -157
  99. data/lib/validator/aa.rb +0 -48
  100. data/lib/validator/aa_est.rb +0 -112
  101. data/lib/validator/background.rb +0 -77
  102. data/lib/validator/bias.rb +0 -95
  103. data/lib/validator/cmdline.rb +0 -431
  104. data/lib/validator/decoy.rb +0 -107
  105. data/lib/validator/digestion_based.rb +0 -70
  106. data/lib/validator/probability.rb +0 -51
  107. data/lib/validator/prot_from_pep.rb +0 -234
  108. data/lib/validator/q_value.rb +0 -32
  109. data/lib/validator/transmem.rb +0 -272
  110. data/lib/validator/true_pos.rb +0 -46
  111. data/lib/validator.rb +0 -197
  112. data/lib/xml.rb +0 -38
  113. data/lib/xml_style_parser.rb +0 -119
  114. data/lib/xmlparser_wrapper.rb +0 -19
  115. data/release_notes.txt +0 -2
  116. data/script/compile_and_plot_smriti_final.rb +0 -97
  117. data/script/create_little_pepxml.rb +0 -61
  118. data/script/degenerate_peptides.rb +0 -47
  119. data/script/estimate_fpr_by_cysteine.rb +0 -226
  120. data/script/extract_gradient_programs.rb +0 -56
  121. data/script/find_cysteine_background.rb +0 -137
  122. data/script/genuine_tps_and_probs.rb +0 -136
  123. data/script/get_apex_values_rexml.rb +0 -44
  124. data/script/histogram_probs.rb +0 -61
  125. data/script/mascot_fix_pepxml.rb +0 -123
  126. data/script/msvis.rb +0 -42
  127. data/script/mzXML2timeIndex.rb +0 -25
  128. data/script/peps_per_bin.rb +0 -67
  129. data/script/prep_dir.rb +0 -121
  130. data/script/simple_protein_digestion.rb +0 -27
  131. data/script/smriti_final_analysis.rb +0 -103
  132. data/script/sqt_to_meta.rb +0 -24
  133. data/script/top_hit_per_scan.rb +0 -67
  134. data/script/toppred_to_yaml.rb +0 -47
  135. data/script/tpp_installer.rb +0 -249
  136. data/specs/align_spec.rb +0 -79
  137. data/specs/bin/bioworks_to_pepxml_spec.rb +0 -79
  138. data/specs/bin/fasta_shaker_spec.rb +0 -259
  139. data/specs/bin/filter_and_validate__multiple_vals_helper.yaml +0 -199
  140. data/specs/bin/filter_and_validate_spec.rb +0 -180
  141. data/specs/bin/ms_to_lmat_spec.rb +0 -34
  142. data/specs/bin/prob_validate_spec.rb +0 -86
  143. data/specs/bin/protein_summary_spec.rb +0 -14
  144. data/specs/fasta_spec.rb +0 -354
  145. data/specs/gi_spec.rb +0 -22
  146. data/specs/load_bin_path.rb +0 -7
  147. data/specs/merge_deep_spec.rb +0 -13
  148. data/specs/ms/gradient_program_spec.rb +0 -77
  149. data/specs/ms/msrun_spec.rb +0 -498
  150. data/specs/ms/parser_spec.rb +0 -92
  151. data/specs/ms/spectrum_spec.rb +0 -87
  152. data/specs/pi_zero_spec.rb +0 -115
  153. data/specs/qvalue_spec.rb +0 -39
  154. data/specs/roc_spec.rb +0 -251
  155. data/specs/rspec_autotest.rb +0 -149
  156. data/specs/sample_enzyme_spec.rb +0 -126
  157. data/specs/spec_helper.rb +0 -135
  158. data/specs/spec_id/aa_freqs_spec.rb +0 -52
  159. data/specs/spec_id/bioworks_spec.rb +0 -148
  160. data/specs/spec_id/digestor_spec.rb +0 -75
  161. data/specs/spec_id/precision/filter/cmdline_spec.rb +0 -20
  162. data/specs/spec_id/precision/filter/output_spec.rb +0 -31
  163. data/specs/spec_id/precision/filter_spec.rb +0 -246
  164. data/specs/spec_id/precision/prob_spec.rb +0 -44
  165. data/specs/spec_id/precision/prob_spec_helper.rb +0 -0
  166. data/specs/spec_id/proph/pep_summary_spec.rb +0 -98
  167. data/specs/spec_id/proph/prot_summary_spec.rb +0 -128
  168. data/specs/spec_id/protein_summary_spec.rb +0 -189
  169. data/specs/spec_id/sequest/params_spec.rb +0 -68
  170. data/specs/spec_id/sequest/pepxml_spec.rb +0 -374
  171. data/specs/spec_id/sequest_spec.rb +0 -38
  172. data/specs/spec_id/sqt_spec.rb +0 -246
  173. data/specs/spec_id/srf_spec.rb +0 -172
  174. data/specs/spec_id/srf_spec_helper.rb +0 -139
  175. data/specs/spec_id_helper.rb +0 -33
  176. data/specs/spec_id_spec.rb +0 -366
  177. data/specs/spec_id_xml_spec.rb +0 -33
  178. data/specs/transmem/phobius_spec.rb +0 -425
  179. data/specs/transmem/toppred_spec.rb +0 -298
  180. data/specs/transmem_spec.rb +0 -60
  181. data/specs/transmem_spec_shared.rb +0 -64
  182. data/specs/validator/aa_est_spec.rb +0 -66
  183. data/specs/validator/aa_spec.rb +0 -40
  184. data/specs/validator/background_spec.rb +0 -67
  185. data/specs/validator/bias_spec.rb +0 -122
  186. data/specs/validator/decoy_spec.rb +0 -51
  187. data/specs/validator/fasta_helper.rb +0 -26
  188. data/specs/validator/prot_from_pep_spec.rb +0 -141
  189. data/specs/validator/transmem_spec.rb +0 -146
  190. data/specs/validator/true_pos_spec.rb +0 -58
  191. data/specs/validator_helper.rb +0 -33
  192. data/specs/xml_spec.rb +0 -12
  193. data/test_files/000_pepxml18_small.xml +0 -206
  194. data/test_files/020a.mzXML.timeIndex +0 -4710
  195. data/test_files/4-03-03_mzXML/000.mzXML.timeIndex +0 -3973
  196. data/test_files/4-03-03_mzXML/020.mzXML.timeIndex +0 -3872
  197. data/test_files/4-03-03_small-prot.xml +0 -321
  198. data/test_files/4-03-03_small.xml +0 -3876
  199. data/test_files/7MIX_STD_110802_1.sequest_params_fragment.srf +0 -0
  200. data/test_files/bioworks-3.3_10prots.xml +0 -5999
  201. data/test_files/bioworks31.params +0 -77
  202. data/test_files/bioworks32.params +0 -62
  203. data/test_files/bioworks33.params +0 -63
  204. data/test_files/bioworks_single_run_small.xml +0 -7237
  205. data/test_files/bioworks_small.fasta +0 -212
  206. data/test_files/bioworks_small.params +0 -63
  207. data/test_files/bioworks_small.phobius +0 -109
  208. data/test_files/bioworks_small.toppred.out +0 -2847
  209. data/test_files/bioworks_small.xml +0 -5610
  210. data/test_files/bioworks_with_INV_small.xml +0 -3753
  211. data/test_files/bioworks_with_SHUFF_small.xml +0 -2503
  212. data/test_files/corrupted_900.srf +0 -0
  213. data/test_files/head_of_7MIX.srf +0 -0
  214. data/test_files/interact-opd1_mods_small-prot.xml +0 -304
  215. data/test_files/messups.fasta +0 -297
  216. data/test_files/opd1/000.my_answer.100lines.xml +0 -101
  217. data/test_files/opd1/000.tpp_1.2.3.first10.xml +0 -115
  218. data/test_files/opd1/000.tpp_2.9.2.first10.xml +0 -126
  219. data/test_files/opd1/000.v2.1.mzXML.timeIndex +0 -3748
  220. data/test_files/opd1/000_020-prot.png +0 -0
  221. data/test_files/opd1/000_020_3prots-prot.mod_initprob.xml +0 -62
  222. data/test_files/opd1/000_020_3prots-prot.xml +0 -62
  223. data/test_files/opd1/opd1_cat_inv_small-prot.xml +0 -139
  224. data/test_files/opd1/sequest.3.1.params +0 -77
  225. data/test_files/opd1/sequest.3.2.params +0 -62
  226. data/test_files/opd1/twenty_scans.mzXML +0 -418
  227. data/test_files/opd1/twenty_scans.v2.1.mzXML +0 -382
  228. data/test_files/opd1/twenty_scans_answ.lmat +0 -0
  229. data/test_files/opd1/twenty_scans_answ.lmata +0 -9
  230. data/test_files/opd1_020_beginning.RAW +0 -0
  231. data/test_files/opd1_2runs_2mods/data/020.mzData.xml +0 -683
  232. data/test_files/opd1_2runs_2mods/data/020.readw.mzXML +0 -382
  233. data/test_files/opd1_2runs_2mods/data/040.mzData.xml +0 -683
  234. data/test_files/opd1_2runs_2mods/data/040.readw.mzXML +0 -382
  235. data/test_files/opd1_2runs_2mods/data/README.txt +0 -6
  236. data/test_files/opd1_2runs_2mods/interact-opd1_mods__small.xml +0 -753
  237. data/test_files/orbitrap_mzData/000_cut.xml +0 -1920
  238. data/test_files/pepproph_small.xml +0 -4691
  239. data/test_files/phobius.small.noheader.txt +0 -50
  240. data/test_files/phobius.small.small.txt +0 -53
  241. data/test_files/s01_anC1_ld020mM.key.txt +0 -25
  242. data/test_files/s01_anC1_ld020mM.meth +0 -0
  243. data/test_files/small.fasta +0 -297
  244. data/test_files/small.sqt +0 -87
  245. data/test_files/smallraw.RAW +0 -0
  246. data/test_files/tf_bioworks2excel.bioXML +0 -14340
  247. data/test_files/tf_bioworks2excel.txt.actual +0 -1035
  248. data/test_files/toppred.small.out +0 -416
  249. data/test_files/toppred.xml.out +0 -318
  250. data/test_files/validator_hits_separate/bias_bioworks_small_HS.fasta +0 -7
  251. data/test_files/validator_hits_separate/bioworks_small_HS.xml +0 -5651
  252. data/test_files/yeast_gly_small-prot.xml +0 -265
  253. data/test_files/yeast_gly_small.1.0_1.0_1.0.parentTimes +0 -6
  254. data/test_files/yeast_gly_small.xml +0 -3807
  255. data/test_files/yeast_gly_small2.parentTimes +0 -6
@@ -1,298 +0,0 @@
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- require File.expand_path( File.dirname(__FILE__) + '/../spec_helper' )
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-
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- # contains shared behavior that we need.
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- require File.expand_path( File.dirname(__FILE__) + '/../transmem_spec_shared' )
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-
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- require 'transmem/toppred'
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- require 'yaml'
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-
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- describe TopPred::Index do
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- before(:all) do
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- @toppred_file = Tfiles + '/toppred.small.out'
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- @obj = TopPred::Index.new(@toppred_file)
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- @test_hash = {"YAL001C"=>0, "YAL011W"=>0, "YAL009W"=>2, "YAL010C"=>1, "YAL008W"=>3, "YAL007C"=>2, "YAL004W"=>0, "YAL005C"=>1, "YAL003W"=>0, "YAL002W"=>3, "YAL013W"=>0, "YAL014C"=>1, "YAL012W"=>1}
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- @ref_to_key= { 'gi|16127905|ref|NP_414542.1| thr operon leader peptide [Escherichia coli K12]' => 'gi_16127905_ref_NP_414542_1_',
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- 'SWN:PWP1_HUMAN PERIODIC TRYPTOPHAN PROTEIN 1 HOMOLOG' => 'SWN_PWP1_HUMAN',
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- 'MY:B|/-"[super]"duper!@#$%^&*(wil) and other stuff' => 'MY_B_____super__duper_________wil_' }
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- end
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- it_should_behave_like 'a transmem index'
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- end
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-
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- describe "a toppred parser", :shared => true do
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- it 'parses a toppred file into a hash structure' do
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- @file_to_hash.exist_as_a_file?.should be_true
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- hash = @class.default_index(@file_to_hash)
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- hash.should == @structure_to_create
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- end
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- end
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-
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- describe "TopPred parsing a text file" do
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- before(:all) do
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- @class = TopPred
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- @file_to_hash = Tfiles + '/toppred.small.out'
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- @structure_to_create = YAML.load(TopPredSupportingFile::MY_YAML1)
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- @structure_to_create.each {|id,hash| string_to_symbol(hash) }
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- end
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- it_should_behave_like 'a toppred parser'
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- end
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-
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- describe "TopPred parsing an xml file" do
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- before(:all) do
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- @class = TopPred
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- @file_to_hash = Tfiles + '/toppred.xml.out'
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- @structure_to_create = YAML.load(TopPredSupportingFile::MY_YAML2)
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- @structure_to_create.each {|id,hash| string_to_symbol(hash) }
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- end
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- it_should_behave_like 'a toppred parser'
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- end
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-
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- describe TopPred::Index do
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- before(:all) do
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- toppred_file = Tfiles + '/toppred.xml.out'
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- @obj = TopPred::Index.new(toppred_file)
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- @tm_test = {
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- :mykey => 'SWN_K1CL_HUMAN',
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- :seqs => %w(GFG VGSGYGGSAFGFG GGGSL),
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- :exps =>
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- {
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- :number => [2.0, 7.0, 3.0],
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- :fraction => [2.0/3, 7.0/13, 3.0/5 ],
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- }
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- }
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- end
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- it_should_behave_like "a calculator of transmembrane overlap"
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- end
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-
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-
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- module TopPredSupportingFile
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- MY_YAML1 = <<END
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- ---
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- YAL011W:
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- aaseq: MPAVLRTRSKESSIEQKPASRTRTRSRRGKRGRDDDDDDDDEESDDAYDEVGNDYDEYASRAKLATNRPFEIVAGLPASVELPNYNSSLTHPQSIKNSGVLYDSLVSSRRTWVQGEMFELYWRRPKKIVSESTPAATESPTSGTIPLIRDKMQKMCDCVMSGGPHTFKVRLFILKNDKIEQKWQDEQELKKKEKELKRKNDAEAKRLRMEERKRQQMQKKIAKEQKLQLQKENKAKQKLEQEALKLKRKEEMKKLKEQNKNKQGSPSSSMHDPRMIMNLNLMAQEDPKLNTLMETVAKGLANNSQLEEFKKFIEIAKKRSLEENPVNKRPSVTTTRPAPPSKAKDVAEDHRLNSITLVKSSKTAATEPEPKKADDENAEKQQSKEAKTTAESTQVDVKKEEEDVKEKGVKSEDTQKKEDNQVVPKRKRRKNAIKEDKDMQLTAFQQKYVQGAEIILEYLEFTHSRYYLPKKSVVEFLEDTDEIIISWIVIHNSKEIEKFKTKKIKAKLKADQKLNKEDAKPGSDVEKEVSFNPLFEADCPTPLYTPMTMKLSGIHKRFNQIIRNSVSPMEEVVKEMEKILQIGTRLSGYNLWYQLDGYDDEALSESLRFELNEWEHAMRSRRHKR
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- num_found: 0
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- YAL001C:
74
- aaseq: MVLTIYPDELVQIVSDKIASNKGKITLNQLWDISGKYFDLSDKKVKQFVLSCVILKKDIEVYCDGAITTKNVTDIIGDANHSYSVGITEDSLWTLLTGYTKKESTIGNSAFELLLEVAKSGEKGINTMDLAQVTGQDPRSVTGRIKKINHLLTSSQLIYKGHVVKQLKLKKFSHDGVDSNPYINIRDHLATIVEVVKRSKNGIRQIIDLKRELKFDKEKRLSKAFIAAIAWLDEKEYLKKVLVVSPKNPAIKIRCVKYVKDIPDSKGSPSFEYDSNSADEDSVSDSKAAFEDEDLVEGLDNFNATDLLQNQGLVMEEKEDAVKNEVLLNRFYPLQNQTYDIADKSGLKGISTMDVVNRITGKEFQRAFTKSSEYYLESVDKQKENTGGYRLFRIYDFEGKKKFFRLFTAQNFQKLTNAEDEISVPKGFDELGKSRTDLKTLNEDNFVALNNTVRFTTDSDGQDIFFWHGELKIPPNSKKTPNKNKRKRQVKNSTNASVAGNISNPKRIKLEQHVSTAQEPKSAEDSPSSNGGTVVKGKVVNFGGFSARSLRSLQRQRAILKVMNTIGGVAYLREQFYESVSKYMGSTTTLDKKTVRGDVDLMVESEKLGARTEPVSGRKIIFLPTVGEDAIQRYILKEKDSKKATFTDVIHDTEIYFFDQTEKNRFHRGKKSVERIRKFQNRQKNAKIKASDDAISKKSTSVNVSDGKIKRRDKKVSAGRTTVVVENTKEDKTVYHAGTKDGVQALIRAVVVTKSIKNEIMWDKITKLFPNNSLDNLKKKWTARRVRMGHSGWRAYVDKWKKMLVLAIKSEKISLRDVEELDLIKLLDIWTSFDEKEIKRPLFLYKNYEENRKKFTLVRDDTLTHSGNDLAMSSMIQREISSLKKTYTRKISASTKDLSKSQSDDYIRTVIRSILIESPSTTRNEIEALKNVGNESIDNVIMDMAKEKQIYLHGSKLECTDTLPDILENRGNYKDFGVAFQYRCKVNELLEAGNAIVINQEPSDISSWVLIDLISGELLNMDVIPMVRNVRPLTYTSRRFEIRTLTPPLIIYANSQTKLNTARKSAVKVPLGKPFSRLWVNGSGSIRPNIWKQVVTMVVNEIIFHPGITLSRLQSRCREVLSLHEISEICKWLLERQVLITTDFDGYWVNHNWYSIYEST
75
- num_found: 0
76
- YAL010C:
77
- num_putative_transmembrane_segments: 1
78
- aaseq: MLPYMDQVLRAFYQSTHWSTQNSYEDITATSRTLLDFRIPSAIHLQISNKSTPNTFNSLDFSTRSRINGSLSYLYSDAQQLEKFMRNSTDIPLQDATETYRQLQPNLNFSVSSANTLSSDNTTVDNDKKLLHDSKFVKKSLYYGRMYYPSSDLEAMIIKRLSPQTQFMLKGVSSFKESLNVLTCYFQRDSHRNLQEWIFSTSDLLCGYRVLHNFLTTPSKFNTSLYNNSSLSLGAEFWLGLVSLSPGCSTTLRYYTHSTNTGRPLTLTLSWQPLFGHISSTYSAKTGTNSTFCAKYDFNLYSIESNLSFGCEFWQKKHHLLETNKNNNDKLEPISDELVDINPNSRATKLLHENVPDLNSAVNDIPSTLDIPVHKQKLLNDLTYAFSSSLRKIDEERSTIEKFDNKINSSIFTSVWKLSTSLRDKTLKLLWEGKWRGFLISAGTELVFTRGFQESLSDDEKNDNAISISATDTENGNIPVFPAKFGIQFQYST
79
- best_structure_probability: 1.0
80
- transmembrane_segments:
81
- - aaseq: SLGAEFWLGLVSLSPGCSTTL
82
- stop: 252
83
- start: 232
84
- probability: 1.0
85
- num_certain_transmembrane_segments: 1
86
- num_found: 2
87
- YAL009W:
88
- num_putative_transmembrane_segments: 0
89
- aaseq: MEPESIGDVGNHAQDDSASIVSGPRRRSTSKTSSAKNIRNSSNISPASMIFRNLLILEDDLRRQAHEQKILKWQFTLFLASMAGVGAFTFYELYFTSDYVKGLHRVILQFTLSFISITVVLFHISGQYRRTIVIPRRFFTSTNKGIRQFNVKLVKVQSTWDEKYTDSVRFVSRTIAYCNIYCLKKFLWLKDDNAIVKFWKSVTIQSQPRIGAVDVKLVLNPRAFSAEIREGWEIYRDEFWAREGARRRKQAHELRPKSE
90
- best_structure_probability: 1.0
91
- transmembrane_segments:
92
- - aaseq: WQFTLFLASMAGVGAFTFYEL
93
- stop: 93
94
- start: 73
95
- probability: 1.0
96
- - aaseq: VILQFTLSFISITVVLFHISG
97
- stop: 126
98
- start: 106
99
- probability: 1.0
100
- num_certain_transmembrane_segments: 2
101
- num_found: 2
102
- YAL008W:
103
- num_putative_transmembrane_segments: 0
104
- aaseq: MTLAFNMQRLVFRNLNVGKRMFKNVPLWRFNVANKLGKPLTRSVGLGGAGIVAGGFYLMNRQPSKLIFNDSLGAAVKQQGPLEPTVGNSTAITEERRNKISSHKQMFLGSLFGVVLGVTVAKISILFMYVGITSMLLCEWLRYKGWIRINLKNIKSVIVLKDVDLKKLLIDGLLGTEYMGFKVFFTLSFVLASLNANK
105
- best_structure_probability: 1.0
106
- transmembrane_segments:
107
- - aaseq: LTRSVGLGGAGIVAGGFYLMN
108
- stop: 60
109
- start: 40
110
- probability: 1.0
111
- - aaseq: AKISILFMYVGITSMLLCEWL
112
- stop: 141
113
- start: 121
114
- probability: 1.0
115
- - aaseq: TEYMGFKVFFTLSFVLASLNA
116
- stop: 196
117
- start: 176
118
- probability: 1.0
119
- num_certain_transmembrane_segments: 3
120
- num_found: 3
121
- YAL007C:
122
- num_putative_transmembrane_segments: 0
123
- aaseq: MIKSTIALPSFFIVLILALVNSVAASSSYAPVAISLPAFSKECLYYDMVTEDDSLAVGYQVLTGGNFEIDFDITAPDGSVITSEKQKKYSDFLLKSFGVGKYTFCFSNNYGTALKKVEITLEKEKTLTDEHEADVNNDDIIANNAVEEIDRNLNKITKTLNYLRAREWRNMSTVNSTESRLTWLSILIIIIIAVISIAQVLLIQFLFTGRQKNYV
124
- best_structure_probability: 1.0
125
- transmembrane_segments:
126
- - aaseq: STIALPSFFIVLILALVNSVA
127
- stop: 24
128
- start: 4
129
- probability: 1.0
130
- - aaseq: LTWLSILIIIIIAVISIAQVL
131
- stop: 201
132
- start: 181
133
- probability: 1.0
134
- num_certain_transmembrane_segments: 2
135
- num_found: 2
136
- YAL005C:
137
- num_putative_transmembrane_segments: 1
138
- aaseq: MSKAVGIDLGTTYSCVAHFANDRVDIIANDQGNRTTPSFVAFTDTERLIGDAAKNQAAMNPSNTVFDAKRLIGRNFNDPEVQADMKHFPFKLIDVDGKPQIQVEFKGETKNFTPEQISSMVLGKMKETAESYLGAKVNDAVVTVPAYFNDSQRQATKDAGTIAGLNVLRIINEPTAAAIAYGLDKKGKEEHVLIFDLGGGTFDVSLLFIEDGIFEVKATAGDTHLGGEDFDNRLVNHFIQEFKRKNKKDLSTNQRALRRLRTACERAKRTLSSSAQTSVEIDSLFEGIDFYTSITRARFEELCADLFRSTLDPVEKVLRDAKLDKSQVDEIVLVGGSTRIPKVQKLVTDYFNGKEPNRSINPDEAVAYGAAVQAAILTGDESSKTQDLLLLDVAPLSLGIETAGGVMTKLIPRNSTISTKKFEIFSTYADNQPGVLIQVFEGERAKTKDNNLLGKFELSGIPPAPRGVPQIEVTFDVDSNGILNVSAVEKGTGKSNKITITNDKGRLSKEDIEKMVAEAEKFKEEDEKESQRIASKNQLESIAYSLKNTISEAGDKLEQADKDTVTKKAEETISWLDSNTTASKEEFDDKLKELQDIANPIMSKLYQAGGAPGGAAGGAPGGFPGGAPPAPEAEGPTVEEVD
139
- best_structure_probability: 1.0
140
- transmembrane_segments:
141
- - aaseq: AGGAPGGAAGGAPGGFPGGAP
142
- stop: 628
143
- start: 608
144
- probability: 1.0
145
- num_certain_transmembrane_segments: 1
146
- num_found: 2
147
- YAL004W:
148
- num_putative_transmembrane_segments: 1
149
- aaseq: MGVTSGGLNFKDTVFNEQQRDIESTTTQVENQDVFFLTLLVQTVSNGSGGRFVNNTQDIQTSNGTSILGSLSLRIVEVSWDSDDSVIDLGSQVRFGSFLHLTQDHGGDLFWGKVLGFTLKFNLNLRLTVNIDQLEWEVLHVSLHFWVVEVSTDQTLSVENGIRRIHSSLILSSITNQSFSVSESDKRWSGSVTLIVGNNVHTIISKVSNTRVCCT
150
- best_structure_probability: 0.06
151
- transmembrane_segments:
152
- - aaseq: QDVFFLTLLVQTVSNGSGGRF
153
- stop: 52
154
- start: 32
155
- probability: 0.06
156
- num_certain_transmembrane_segments: 0
157
- num_found: 1
158
- YAL003W:
159
- aaseq: MASTDFSKIETLKQLNASLADKSYIEGTAVSQADVTVFKAFQSAYPEFSRWFNHIASKADEFDSFPAASAAAAEEEEDDDVDLFGSDDEEADAEAEKLKAERIAAYNAKKAAKPAKPAAKSIVTLDVKPWDDETNLEEMVANVKAIEMEGLTWGAHQFIPIGFGIKKLQINCVVEDDKVSLDDLQQSIEEDEDHVQSTDIAAMQKL
160
- num_found: 0
161
- YAL014C:
162
- num_putative_transmembrane_segments: 0
163
- aaseq: MDVLKLGYELDQLSDLVEERTRLVSVLKLAPTSNDNVTLKRQLGSILELLQKCAPNDELISRYNTILDKIPDTAVDKELYRFQQQVARNTDEVSKESLKKVRFKNDDELTVMYKDDDEQDEESPLPSTHTPYKDEPLQSQLQSQSQPQPPQPMVSNQELFINQQQQLLEQDSHLGALSQSIGRTHDISLDLNNEIVSQNDSLLVDLENLIDNNGRNLNRASRSMHGFNNSRFKDNGNCVIILVLIVVLLLLLLVL
164
- best_structure_probability: 1.0
165
- transmembrane_segments:
166
- - aaseq: NGNCVIILVLIVVLLLLLLVL
167
- stop: 255
168
- start: 235
169
- probability: 1.0
170
- num_certain_transmembrane_segments: 1
171
- num_found: 1
172
- YAL013W:
173
- num_putative_transmembrane_segments: 1
174
- aaseq: MSQQTPQESEQTTAKEQDLDQESVLSNIDFNTDLNHNLNLSEYCISSDAGTEKMDSDEEKSLANLPELKYAPKLSSLVKQETLTESLKRPHEDEKEAIDEAKKMKVPGENEDESKEEEKSQELEEAIDSKEKSTDARDEQGDEGDNEEENNEEDNENENEHTAPPALVMPSPIEMEEQRMTALKEITDIEYKFAQLRQKLYDNQLVRLQTELQMCLEGSHPELQVYYSKIAAIRDYKLHRAYQRQKYELSCINTETIATRTFIHQDFHKKVTDLRARLLNRTTQTWYDINKERRDMDIVIPDVNYHVPIKLDNKTLSCITGYASAAQLCYPGEPVAEDLACESIEYRYRANPVDKLEVIVDRMRLNNEISDLEGLRKYFHSFPGAPELNPLRDSEINDDFHQWAQCDRHTGPHTTSFCYS
175
- best_structure_probability: 0.08
176
- transmembrane_segments:
177
- - aaseq: KTLSCITGYASAAQLCYPGEP
178
- stop: 334
179
- start: 314
180
- probability: 0.08
181
- num_certain_transmembrane_segments: 0
182
- num_found: 1
183
- YAL002W:
184
- num_putative_transmembrane_segments: 2
185
- aaseq: MEQNGLDHDSRSSIDTTINDTQKTFLEFRSYTQLSEKLASSSSYTAPPLNEDGPKGVASAVSQGSESVVSWTTLTHVYSILGAYGGPTCLYPTATYFLMGTSKGCVLIFNYNEHLQTILVPTLSEDPSIHSIRSPVKSIVICSDGTHVAASYETGNICIWNLNVGYRVKPTSEPTNGMTPTPALPAVLHIDDHVNKEITGLDFFGARHTALIVSDRTGKVSLYNGYRRGFWQLVYNSKKILDVNSSKEKLIRSKLSPLISREKISTNLLSVLTTTHFALILLSPHVSLMFQETVEPSVQNSLVVNSSISWTQNCSRVAYSVNNKISVISISSSDFNVQSASHSPEFAESILSIQWIDQLLLGVLTISHQFLVLHPQHDFKILLRLDFLIHDLMIPPNKYFVISRRSFYLLTNYSFKIGKFVSWSDITLRHILKGDYLGALEFIESLLQPYCPLANLLKLDNNTEERTKQLMEPFYNLSLAALRFLIKKDNADYNRVYQLLMVVVRVLQQSSKKLDSIPSLDVFLEQGLEFFELKDNAVYFEVVANIVAQGSVTSISPVLFRSIIDYYAKEENLKVIEDLIIMLNPTTLDVDLAVKLCQKYNLFDLLIYIWNKIFDDYQTPVVDLIYRISNQSEKCVIFNGPQVPPETTIFDYVTYILTGRQYPQNLSISPSDKCSKIQRELSAFIFSGFSIKWPSNSNHKLYICENPEEEPAFPYFHLLLKSNPSRFLAMLNEVFEASLFNDDNDMVASVGEAELVSRQYVIDLLLDAMKDTGNSDNIRVLVAIFIATSISKYPQFIKVSNQALDCVVNTICSSRVQGIYEISQIALESLLPYYHSRTTENFILELKEKNFNKVLFHIYKSENKYASALSLILETKDIEKEYNTDIVSITDYILKKCPPGSLECGKVTEVIETNFDLLLSRIGIEKCVTIFSDFDYNLHQEILEVKNEETQQKYLDKLFSTPNINNKVDKRLRNLHIELNCKYKSKREMILWLNGTVLSNAESLQILDLLNQDSNFEAAAIIHERLESFNLAVRDLLSFIEQCLNEGKTNISTLLESLRRAFDDCNSAGTEKKSCWILLITFLITLYGKYPSHDERKDLCNKLLQEAFLGLVRSKSSSQKDSGGEFWEIMSSVLEHQDVILMKVQDLKQLLLNVFNTYKLERSLSELIQKIIEDSSQDLVQQYRKFLSEGWSIHTDDCEICGKKIWGAGLDPLLFLAWENVQRHQDMISVDLKTPLVIFKCHHGFHQTCLENLAQKPDEYSCLICQTESNPKIV
186
- best_structure_probability: 1.0
187
- transmembrane_segments:
188
- - aaseq: GAYGGPTCLYPTATYFLMGTS
189
- stop: 102
190
- start: 82
191
- probability: 1.0
192
- - aaseq: TNLLSVLTTTHFALILLSPHV
193
- stop: 286
194
- start: 266
195
- probability: 1.0
196
- - aaseq: KKSCWILLITFLITLYGKYPS
197
- stop: 1092
198
- start: 1072
199
- probability: 1.0
200
- num_certain_transmembrane_segments: 3
201
- num_found: 5
202
- YAL012W:
203
- num_putative_transmembrane_segments: 0
204
- aaseq: MTLQESDKFATKAIHAGEHVDVHGSVIEPISLSTTFKQSSPANPIGTYEYSRSQNPNRENLERAVAALENAQYGLAFSSGSATTATILQSLPQGSHAVSIGDVYGGTHRYFTKVANAHGVETSFTNDLLNDLPQLIKENTKLVWIETPTNPTLKVTDIQKVADLIKKHAAGQDVILVVDNTFLSPYISNPLNFGADIVVHSATKYINGHSDVVLGVLATNNKPLYERLQFLQNAIGAIPSPFDAWLTHRGLKTLHLRVRQAALSANKIAEFLAADKENVVAVNYPGLKTHPNYDVVLKQHRDALGGGMISFRIKGGAEAASKFASSTRLFTLAESLGGIESLLEVPAVMTHGGIPKEAREASGVFDDLVRISVGIEDTDDLLEDIKQALKQATN
205
- best_structure_probability: 1.0
206
- transmembrane_segments:
207
- - aaseq: QYGLAFSSGSATTATILQSLP
208
- stop: 92
209
- start: 72
210
- probability: 1.0
211
- num_certain_transmembrane_segments: 1
212
- num_found: 1
213
- END
214
-
215
- MY_YAML2 = <<END_YAML2
216
- ---
217
- SWN_SM33_HUMAN:
218
- aaseq: MSDQEAKPSTEDLGDKKEGEYIKLKVIGQDSSEIHFKVKMTTHLKKLKESYCQRQGVPMNSLRFLFEGQRIADNHTPKELGMEEEDVIEVYQEQTGGHSTV
219
- num_found: 0
220
- SWN_UBP3_HUMAN:
221
- num_putative_transmembrane_segments: 1
222
- transmembrane_segments:
223
- - aaseq: TMPGYGGAASAGASVFGASGL
224
- stop: 724
225
- start: 704
226
- probability: 21.0
227
- - aaseq: YELFAFISHMGTSTMSGHYIC
228
- stop: 826
229
- start: 806
230
- probability: 21.0
231
- aaseq: MQRRGALFGMPGGSGGRKMAAGDIGELLVPHMPTIRVPRSGDRVYKNECAFSYDSPNSEGGLYVCMNTFLAFGREHVERHFRKTGQSVYMHLKRHAREKVRGASGGALPKRRNSKIFLDLDTDDDLNSDDYEYEDEAKLVIFPDHYEIALPNIEELPALVTIACDAVLSSKSPYRKQDPDTWENELPVSKYANNLTQLDNGVRIPPSGWKCARCDLRENLWLNLTDGSVLCGKWFFDSSGGNGHALEHYRDMGYPLAVKLGTITPDGADVYSFQEEEPVLDPHLAKHLAHFGIDMLHMHGTENGLQDNDIKLRVSEWEVIQESGTKLKPMYGPGYTGLKNLGNSCYLSSVMQAIFSIPEFQRAYVGNLPRIFDYSPLDPTQDFNTQMTKLGHGLLSGQYSKPPVKSELIEQVMKEEHKPQQNGISPRMFKAFVSKSHPEFSSNRQQDAQEFFLHLVNLVERNRIGSENPSDVFRFLVEERIQCCQTRKVRYTERVDYLMQLPVAMEAATNKDELIAYELTRREAEANRRPLPELVRAKIPFSACLQAFSEPENVDDFWSSALQAKSAGVKTSRFASFPEYLVVQIKKFTFGLDWVPKKFDVSIDMPDLLDINHLRARGLQPGEEELPDISPPIVIPDDSKDRLMNQLIDPSDIDESSVMQLAEMGFPLEACRKAVYFTGNMGAEVAFNWIIVHMEEPDFAEPLTMPGYGGAASAGASVFGASGLDNQPPEEIVAIITSMGFQRNQAIQALRATNNNLERALDWIFSHPEFEEDSDFVIEMENNANANIISEAKPEGPRVKDGSGTYELFAFISHMGTSTMSGHYICHIKKEGRWVIYNDHKVCASERPPKDLGYMYFYRRIPS
232
- num_certain_transmembrane_segments: 2
233
- num_found: 3
234
- SWN_UBPN_HUMAN:
235
- num_putative_transmembrane_segments: 3
236
- transmembrane_segments:
237
- - aaseq: PSSTSSASALYGQPLLLSVPK
238
- stop: 556
239
- start: 536
240
- probability: 21.0
241
- aaseq: MYNVGEHNLFPGPIDNSGLFSDPESQTLKEHLIDELDYVLVPTEAWNKLLNWYGCVEGQQPIVRKVVEHGLFVKHCKVEVYLLELKLCENSDPTNVLSCHFSKADTIATIEKEMRKLFNIPAERETRLWNKYMSNTYEQLSKLDNTVQDAGLYQGQVLVIEPQNEDGTWPRQTLQSKSSTAPSRNFTTSPKSSASPYSSVSASLIANGDSTSTCGMHSSGVSRGGSGFSASYNCQEPPSSHIQPGLCGLGNLGNTCFMNSALQCLSNTHPLTDYFLKDEYEAEINRDNPLGMKGEIAEAYAELIKQMWSGRDAHVAPWMFKTQVGRFAPQFSGYQQQDSQELLAFPSRWIHEDLNRVKKKPYLELKDANGRPDAVVAKEAWENHRLRNDSVIVDTFHGLFKSTLVCPECAKVSVTFDPFCYLTLPLPLKKDRVMEVFLVPADPHCRPTQYRVTVPLMGAVSDLCEALSRLSGIAAENMVVADVYNHRFHKIFQMDEGLNHIMPRDDIFVYEVCSTSVDGSECVTLPVYFRERKSRPSSTSSASALYGQPLLLSVPKHKLTLESLYQAVCDRISRYVKQPLPDEFGSSPLEPGACNGSRNSCEGEDEEEMEHQEEGKEQLSETEGSGEDEPGNDPSETTQKKIKGQPCPKRLFTFSLVNSYGTADINSLAADGKLLKLNSRSTLAMDWDRETRRLYYDEQESEAYEKHVSMLQPQKKKKTTVALRDCIELFTTMETLGEHDPWYCPNCKKHQQATKKFDLWSLPKILVVHLKRFSYNRYWRDKLDTVVEFPIRGLNMSEFVCNLSARPYVYDLIAVSNHYGAMGVGHYTAYAKNKLNGKWYYFDDSNVSWPLRIR
242
- num_certain_transmembrane_segments: 0
243
- num_found: 3
244
- SWN_PWP1_HUMAN:
245
- num_putative_transmembrane_segments: 0
246
- transmembrane_segments:
247
- - aaseq: MGVLFCSSCCPDLPFIYAFGG
248
- stop: 450
249
- start: 430
250
- probability: 21.0
251
- aaseq: MNRSRQVTCVAWVRCGVAKETPDKVELSKEEVKRLIAEAKEKLQEEGGGSDEEETGSPSEDGMQSARTQARPREPLEDGDPEDDRTLDDDELAEYDLDKYDEEGDPDAETLGESLLGLTVYGSNDQDPYVTLKDTEQYEREDFLIKPSDNLIVCGRAEQDQCNLEVHVYNQEEDSFYVHHDILLSAYPLSVEWLNFDPSPDDSTGNYIAVGNMTPVIEVWDLDIVDSLEPVFTLGSKLSKKKKKKGKKSSSAEGHTDAVLDLSWNKLIRNVLASASADNTVILWDMSLGKPAASLAVHTDKVQTLQFHPFEAQTLISGSYDKSVALYDCRSPDESHRMWRFSGQIERVTWNHFSPCHFLASTDDGFVYNLDARSDKPIFTLNAHNDEISGLDLSSQIKGCLVTASADKYVKIWDILGDRPSLVHSRDMKMGVLFCSSCCPDLPFIYAFGGQKEGLRVWDISTVSSVNEAFGRRERLVLGSARNSSISGPFGSRSSDTPMES
252
- num_certain_transmembrane_segments: 1
253
- num_found: 1
254
- SW_FGF7_HUMAN:
255
- num_putative_transmembrane_segments: 0
256
- transmembrane_segments:
257
- - aaseq: RSCFHIICLVGTISLACNDMT
258
- stop: 36
259
- start: 16
260
- probability: 21.0
261
- aaseq: MHKWILTWILPTLLYRSCFHIICLVGTISLACNDMTPEQMATNVNCSSPERHTRSYDYMEGGDIRVRRLFCRTQWYLRIDKRGKVKGTQEMKNNYNIMEIRTVAVGIVAIKGVESEFYLAMNKEGKLYAKKECNEDCNFKELILENHYNTYASAKWTHNGGEMFVALNQKGIPVRGKKTKKEQKTAHFLPMAIT
262
- num_certain_transmembrane_segments: 1
263
- num_found: 1
264
- SWN_SM31_HUMAN:
265
- aaseq: MSEEKPKEGVKTENDHINLKVAGQDGSVVQFKIKRHTSLSKLMKAYCERQGLSMRQIRFRFDGQPINETDTPAQLRMEDEDTIDVFQQQTGGVPESSLAGHSF
266
- num_found: 0
267
- SWN_UFD1_HUMAN:
268
- aaseq: MFSFNMFDHPIPRVFQNRFSTQYRCFSVSMLAWPNDRSDVEKGGKIIMPPSALDQLSRLNITYPMLFKLTNKNSDRMTHCGVLEFVADEGICYLPHWMMQNLLLEEDGLVQLETVNLQVATYSKSKFCYLPHWMMQNLLLEEGGLVQVESVNLQVATYSKFQPQSADFLDITNPKAVLENALRNFACLTTGDVIAINYNEKIYELRVMETKPDKAVSIHECDMNVDFDAPLGYKEPERQVQHEESTEGEADHSGYAGELGFRAFSGSGNRLDGKKKGVEPSPSPIKPGDIKRGIPNYEFKLGKITFIRNSRPLVKKVEEDEAGGRFVAFSGEGQSLRKKGRKP
269
- num_found: 0
270
- SWN_UBCE_HUMAN:
271
- aaseq: MNSNVENLPPHIIRLVYKEVTTLTADPPDGIKVFPNEEDLTDLQVTIEGPEGTPYAGGLFRMKLLLGKDFPASPPKGYFLTKIFHPNVGANGEICVNVLKRDWTAELGIRHVLLTIKCLLIHPNPESALNEEAGRLLLENYEEYAARARLLTEIHGGAGGPSGRAEAGRALASGTEASSTDPGAPGGPGGAEGPMAKKHAGERDKKLAAKKKTDKKRALRALRRL
272
- num_found: 0
273
- SWN_K1CL_HUMAN:
274
- num_putative_transmembrane_segments: 0
275
- transmembrane_segments:
276
- - aaseq: GSAFGFGASCGGGFSAASMFG
277
- stop: 64
278
- start: 44
279
- probability: 21.0
280
- - aaseq: ALGGGSFGGLGMGFGGSPGGG
281
- stop: 108
282
- start: 88
283
- probability: 21.0
284
- aaseq: MDLSNNTMSLSVRTPGLSRRLSSQSVIGRPRGMSASSVGSGYGGSAFGFGASCGGGFSAASMFGSSSGFGGGSGSSMAGGLGAGYGRALGGGSFGGLGMGFGGSPGGGSLGILSGNDGGLLSGSEKETMQNLNDRLASYLDKVRALEEANTELENKIREWYETRGTGTADASQSDYSKYYPLIEDLRNKIISASIGNAQLLLQIDNARLAAEDFRMKYENELALRQGVEADINGLRRVLDELTLTRTDLEMQIESLNEELAYMKKNHEDELQSFRVGGPGEVSVEMDAAPGVDLTRLLNDMRAQYETIAEQNRKDAEAWFIEKSGELRKEISTNTEQLQSSKSEVTDLRRAFQNLEIELQSQLAMKKSLEDSLAEAEGDYCAQLSQVQQLISNLEAQLLQVRADAERQNVDHQRLLNVKARLELEIETYRRLLDGEAQGDGLEESLFVTDSKSQAQSTDSSKDPTKTRKIKTVVQEMVNGEVVSSQVQEIEELM
285
- num_certain_transmembrane_segments: 2
286
- num_found: 2
287
- SWN_UBCC_HUMAN:
288
- aaseq: MAGLPRRIIKETQRLLAEPVPGIKAEPDESNARYFHVVIAGPQDSPFEGGTFKLELFLPEEYPMAAPKVRFMTKIYHPNVDKLGRICLDILKDKWSPALQIRTVLLSIQALLSAPNPDDPLANDVAEQWKTNEAQAIETARAWTRLYAMNNI
289
- num_found: 0
290
- SWN_SM32_HUMAN:
291
- aaseq: MADEKPKEGVKTENNDHINLKVAGQDGSVVQFKIKRHTPLSKLMKAYCERQGLSMRQIRFRFDGQPINETDTPAQLEMEDEDTIDVFQQQTGGVY
292
- num_found: 0
293
- END_YAML2
294
-
295
- end
296
-
297
-
298
-
@@ -1,60 +0,0 @@
1
- require File.expand_path( File.dirname(__FILE__) + '/spec_helper' )
2
- require File.expand_path( File.dirname(__FILE__) + '/transmem_spec_shared' )
3
- require 'transmem'
4
-
5
- # turns all string keys into symbol keys
6
- def string_to_symbol(hash)
7
- if hash.is_a? Hash
8
- hash.each do |k,v|
9
- hash[k.to_sym] = hash.delete(k)
10
- if v.is_a? Hash
11
- string_to_symbol(v)
12
- elsif v.is_a? Array
13
- v.each do |armemb|
14
- string_to_symbol(armemb)
15
- end
16
- end
17
- end
18
- end
19
- end
20
-
21
- describe TransmemIndex, "determining filetypes" do
22
- before(:each) do
23
- @files = %w(toppred.small.out toppred.xml.out phobius.small.small.txt phobius.small.noheader.txt).map {|f| Tfiles + '/' + f }
24
- @types = %w(toppred toppred phobius phobius).map {|v| v.to_sym }
25
- @classes = %w(TopPred TopPred Phobius Phobius).map {|v| v.to_sym }
26
- end
27
- it 'figures out the filetype' do
28
- @files.zip(@types) do |file,tp|
29
- TransmemIndex.filetype(file).should == tp
30
- end
31
- end
32
- it 'given a file to initalize, returns the right object' do
33
- objects = @files.zip(@classes) do |file,base_klass|
34
- obj = TransmemIndex.new(file)
35
- base = Kernel.const_get(base_klass)
36
- klass = base.const_get(:Index)
37
- obj.class.should == klass
38
- end
39
- end
40
- end
41
-
42
-
43
-
44
- describe TransmemIndex, "methods" do
45
- it 'calculates the num of overlapping chars in start/stop seqs' do
46
- ##########0 1 2 3 4 5 6
47
- ##########01234567890123456789012345678901234567890123456789012345678901
48
- ########## **** **** ** ***
49
- string = 'ABCDEFG ABCDEFG ABCDEFG CATTITY ABCD EFG CD BCDEFGTTITY BCDEFG'
50
- ########## ^^^^^^ ^^^^^^ ^^^^^^ ^^^^^^ ^^^^^^
51
- #
52
- substring = 'BCDEFG'
53
- ranges = [(3..6), (16..19), (43..44), (48..50)]
54
- expected = [4, 0, 3, 3, 0]
55
- class TMshell ; include TransmemIndex ; end
56
- TMshell.new.num_overlapping_chars(string, ranges, substring).should == expected
57
- end
58
- end
59
-
60
-
@@ -1,64 +0,0 @@
1
-
2
- # turns all string keys into symbol keys
3
- def string_to_symbol(hash)
4
- if hash.is_a? Hash
5
- hash.each do |k,v|
6
- hash[k.to_sym] = hash.delete(k)
7
- if v.is_a? Hash
8
- string_to_symbol(v)
9
- elsif v.is_a? Array
10
- v.each do |armemb|
11
- string_to_symbol(armemb)
12
- end
13
- end
14
- end
15
- end
16
- end
17
-
18
-
19
-
20
- describe "a transmem index", :shared => true do
21
- before(:all) do
22
- # expects an transmem object, @obj
23
- end
24
-
25
- it 'is a hash' do
26
- @obj.is_a?(Hash).should be_true
27
- end
28
-
29
- it 'responds to reference_to_key' do
30
- @obj.respond_to?(:reference_to_key).should be_true
31
- end
32
-
33
- it "correctly transforms headers or refs into id's" do
34
- @ref_to_key.each do |k,v|
35
- @obj.reference_to_key(k).should == v
36
- end
37
- end
38
-
39
- it "creates a num_certain_index that gives correct values given keys" do
40
- ind = @obj.num_certain_index
41
- @test_hash.each do |k,v|
42
- ind[@obj.reference_to_key(k)].should == v
43
- end
44
- end
45
- end
46
-
47
-
48
- describe "a calculator of transmembrane overlap", :shared => true do
49
- # require definition of @tm_test and @obj
50
-
51
- it "can give average overlap given a sequence (fraction)" do
52
- [:number, :fraction].each do |tp|
53
- #[:fraction, :number].each do |tp|
54
- hash = @tm_test
55
- key = hash[:mykey]
56
- hash[:seqs].zip(hash[:exps][tp]) do |seq,exp|
57
- @obj.avg_overlap(key, seq, tp).should == exp
58
- end
59
- end
60
- end
61
-
62
- end
63
-
64
-
@@ -1,66 +0,0 @@
1
- require File.expand_path( File.dirname(__FILE__) + '/../spec_helper' )
2
- require File.expand_path( File.dirname(__FILE__) + '/../validator_helper' )
3
-
4
-
5
- require 'validator/aa_est'
6
- require 'spec_id'
7
- require 'spec_id/digestor'
8
-
9
- klass = Validator::AAEst
10
-
11
- describe klass, "using frequency estimates" do
12
- before(:each) do
13
- @small_fasta = Tfiles + '/small.fasta'
14
- @sequest_params = Tfiles + '/bioworks32.params'
15
- # C/D C/D J (7)
16
- @seqs = %w(ABCDEFGC CCDCCC JJJJJ XYZ WXXXYZ TXXXXXYZ ZZXIIPTYZ ZZXTYZZ ZZZZ YYYYYTL)
17
- @peps = @seqs.map {|n| v = SpecID::GenericPep.new; v.aaseq = n ; v }
18
- val = klass.new('C')
19
- val.frequency = 0.11
20
- @validator = val
21
- end
22
- #C: 0.0157714433456144
23
- #D: 0.0526145691939758
24
-
25
- it_should_behave_like 'a validator'
26
-
27
- it 'calculates false_to_total_ratio correctly' do
28
- obj = klass.new('C', :frequency => 0.0157714433456144)
29
- obj.set_false_to_total_ratio(@peps)
30
- exp = 0.949318337979434 / @seqs.size
31
- obj.false_to_total_ratio.should be_close(exp, 0.0001) # freeze for consistency
32
- end
33
-
34
- it 'calculates fttr each time fresh' do
35
- myar = @peps.map
36
- obj = klass.new('C', :frequency => 0.0157714433456144)
37
- obj.pephit_precision(myar)
38
- fttr1 = obj.false_to_total_ratio
39
- obj.pephit_precision(myar)
40
- fttr2 = obj.false_to_total_ratio
41
- fttr1.should == fttr2
42
- myar.pop
43
- obj.pephit_precision(myar)
44
- fttr3 = obj.false_to_total_ratio
45
- fttr3.should_not == fttr1
46
- end
47
-
48
- it 'gives consistent precision of peptides given fastafile and aa (even negative)' do
49
- aa = 'C'
50
- val = klass.new(aa).set_frequency(Fasta.new(@small_fasta).prots)
51
- # I checked this answer out by hand and it is correct
52
- val.pephit_precision(@peps).should be_close(-1.10677, 0.001)
53
- end
54
-
55
- it 'gives same precision done at once or incrementally' do
56
- obj = klass.new('C', :frequency => 0.0157714433456144)
57
-
58
- all_at_once = obj.pephit_precision(@peps)
59
-
60
- precisions = @peps.map do |pep|
61
- obj.increment_pephits_precision(pep)
62
- end
63
- precisions.last.should == all_at_once
64
- end
65
- end
66
-
@@ -1,40 +0,0 @@
1
- require File.expand_path( File.dirname(__FILE__) + '/../spec_helper' )
2
- require File.expand_path( File.dirname(__FILE__) + '/../validator_helper' )
3
-
4
-
5
- require 'validator/aa'
6
- require 'spec_id'
7
- require 'spec_id/digestor'
8
-
9
- klass = Validator::AA
10
-
11
- class MyAA < Validator::AA ; def initialize ; end ; end
12
-
13
- describe klass, "using digestion data" do
14
-
15
- before(:each) do
16
- @small_fasta = Tfiles + '/small.fasta'
17
- @sequest_params = Tfiles + '/bioworks32.params'
18
- # C/D C/D J (7)
19
- @seqs = %w(ABCDEFGC CCDCCC JJJJJ XYZ WXXXYZ TXXXXXYZ ZZXIIPTYZ ZZXTYZZ ZZZZ YYYYYTL)
20
- @peps = @seqs.map {|n| v = SpecID::GenericPep.new; v.aaseq = n ; v }
21
-
22
- val = klass.new('C')
23
- val.false_to_total_ratio = 0.22 # arbitrary
24
- @validator = val
25
- end
26
-
27
- it_should_behave_like 'a validator'
28
-
29
- it 'gives correct false to total ratio' do
30
- aa = 'C'
31
- val = klass.new(aa)
32
- peptides = Digestor.digest( Fasta.new(@small_fasta), Sequest::Params.new(@sequest_params))
33
- val.set_false_to_total_ratio( peptides )
34
- # frozen (but I checked the peptides by hand to make sure they were
35
- # correct)
36
- val.false_to_total_ratio.should be_close(0.177629264861062, 0.0000000000001)
37
- end
38
- end
39
-
40
-
@@ -1,67 +0,0 @@
1
- require 'yaml'
2
-
3
- require File.expand_path( File.dirname(__FILE__) + '/../spec_helper' )
4
-
5
- require 'validator/background'
6
-
7
- describe Validator::Background do
8
-
9
- before(:all) do
10
- @expected = YAML.load("badAA: 45
11
- tpred-1: 36
12
- tpred-1-0.8: 36
13
- tpred-2: 36
14
- tpred-2-0.8: 36
15
- phob-1: 38
16
- phob-2: 37
17
- phob-1-0.8: 38
18
- phob-2-0.8: 37
19
- bias-mrna: 29
20
- bias-prot: 37
21
- ")
22
- @data =
23
- {
24
- 'badAA' => [0.158873276514528, 0.15968405463222, 0.159870678279229, 0.159635650410558, 0.156543159883917, 0.152783096042051, 0.150294985250737, 0.145335608646189, 0.134808758575322, 0.125552050473186, 0.112790697674419, 0.0960860693748841, 0.076310861423221, 0.0560216123986919, 0.0388044914134742, 0.0250922509225092, 0.0187774670395525, 0.0111182381868719, 0.00934787447139996, 0.00583022388059702, 0.00460382844681367, 0.00348518795120737, 0.00284164298630845, 0.0021488047273704, 0.00167177486765116, 0.00175080245112343, 0.00182926829268293, 0.00191570881226054, 0.0016767270288397, 0.00177116542685087, 0.00186219739292365, 0.00198491464867011, 0.00211864406779661, 0.00136986301369863, 0.00146412884333821, 0.00107642626480086, 0.00120336943441637, 0.000672494956287828, 0.000764525993883792, 0.000887311446317658, 0.00103734439834025, 0.00123609394313968, 0.00151975683890578, 0.00179856115107914, 0.00215982721382289, 0.00266666666666667, 0.0, 0.0, 0.0, 0.0, 0.0/0.0],
25
- 'tpred-1-0.8' => [0.432087342709104, 0.430464886251236, 0.432952622673435, 0.430709911544568, 0.431700713758307, 0.426344086021505, 0.42326139088729, 0.412998624484182, 0.405773857257418, 0.395963479096588, 0.379389752446747, 0.375838926174497, 0.371165644171779, 0.366496598639456, 0.351903435468895, 0.337611056268509, 0.334031413612565, 0.332236842105263, 0.335585585585586, 0.334894613583138, 0.33133971291866, 0.334558823529412, 0.331658291457286, 0.328998699609883, 0.330175913396482, 0.334745762711864, 0.332844574780059, 0.327188940092166, 0.317152103559871, 0.320689655172414, 0.323583180987203, 0.324271844660194, 0.322245322245322, 0.317180616740088, 0.324644549763033, 0.323834196891192, 0.32183908045977, 0.327044025157233, 0.316363636363636, 0.311203319502075, 0.314553990610329, 0.318918918918919, 0.306122448979592, 0.307086614173228, 0.295238095238095, 0.255555555555556, 0.246753246753247, 0.254237288135593, 0.290322580645161, 0.3, 0.0/0.0],
26
- 'tpred-2-0.8' => [0.193930421909697, 0.194460929772502, 0.193104906937394, 0.188931730551145, 0.187792271720404, 0.181989247311828, 0.176558752997602, 0.172627235213205, 0.168003207698476, 0.157135992311389, 0.145653425446172, 0.136241610738255, 0.125766871165644, 0.122448979591837, 0.115134633240483, 0.107601184600197, 0.103664921465969, 0.103070175438596, 0.102477477477477, 0.101873536299766, 0.101674641148325, 0.10171568627451, 0.101758793969849, 0.0988296488946684, 0.0987821380243572, 0.100282485875706, 0.095307917888563, 0.0921658986175115, 0.0809061488673139, 0.0793103448275862, 0.0822669104204753, 0.0757281553398058, 0.079002079002079, 0.0814977973568282, 0.0853080568720379, 0.0803108808290155, 0.0718390804597701, 0.0786163522012579, 0.0836363636363636, 0.0746887966804979, 0.07981220657277, 0.0756756756756757, 0.0748299319727891, 0.062992125984252, 0.0666666666666667, 0.0555555555555556, 0.025974025974026, 0.0338983050847458, 0.032258064516129, 0.0, 0.0/0.0],
27
- 'tpred-1' => [0.43492586490939, 0.434656516222585, 0.437751004016064, 0.439366015481017, 0.435423665546846, 0.432272813869308, 0.432531593966572, 0.422057502246181, 0.419948186528497, 0.413091136861885, 0.395751376868607, 0.39067055393586, 0.379793061472915, 0.378066378066378, 0.366721854304636, 0.348222424794895, 0.34251968503937, 0.339958158995816, 0.343073593073593, 0.343502824858757, 0.337587006960557, 0.33969010727056, 0.336196319018405, 0.332909783989835, 0.334656084656085, 0.339779005524862, 0.339055793991416, 0.331831831831832, 0.323343848580442, 0.326050420168067, 0.329181494661922, 0.330170777988615, 0.325865580448065, 0.321814254859611, 0.326340326340326, 0.322250639386189, 0.320113314447592, 0.325077399380805, 0.314285714285714, 0.308943089430894, 0.311926605504587, 0.317460317460317, 0.304635761589404, 0.305343511450382, 0.293577981651376, 0.258064516129032, 0.253164556962025, 0.262295081967213, 0.303030303030303, 0.333333333333333, 0.0/0.0],
28
- 'tpred-2' => [0.197144426139484, 0.197571143737539, 0.197699890470975, 0.195355694802801, 0.192422545726017, 0.191465040960183, 0.188544639217285, 0.185085354896676, 0.184974093264249, 0.176636392107736, 0.164044059795437, 0.154518950437318, 0.143639683505782, 0.137085137085137, 0.129966887417219, 0.113035551504102, 0.108267716535433, 0.105648535564854, 0.103896103896104, 0.105084745762712, 0.103248259860789, 0.103694874851013, 0.101840490797546, 0.0991105463786531, 0.0992063492063492, 0.100828729281768, 0.0958512160228898, 0.0930930930930931, 0.082018927444795, 0.0789915966386555, 0.0818505338078292, 0.0759013282732448, 0.0794297352342159, 0.08207343412527, 0.0839160839160839, 0.0792838874680307, 0.0708215297450425, 0.0773993808049536, 0.0821428571428571, 0.0731707317073171, 0.0779816513761468, 0.0740740740740741, 0.0728476821192053, 0.0610687022900763, 0.0642201834862385, 0.0537634408602151, 0.0253164556962025, 0.0327868852459016, 0.0303030303030303, 0.0, 0.0/0.0],
29
- 'phob-1-0.8' => [0.185672175669857, 0.18433572392246, 0.181897765767137, 0.178760843645932, 0.176211849192101, 0.17261698440208, 0.168649249583102, 0.164665082525207, 0.158626390141268, 0.149688712442479, 0.140255798829395, 0.127386902473408, 0.116115516983391, 0.106017191977077, 0.0974025974025974, 0.0923076923076923, 0.0875342754693103, 0.0849369608493696, 0.0839240795792362, 0.0830359267190102, 0.0802955665024631, 0.0777188998233661, 0.0760188087774295, 0.0748373101952278, 0.0739595050618673, 0.0732568402471315, 0.0716041794714198, 0.070096463022508, 0.0682432432432432, 0.0678329168154231, 0.0672174239579422, 0.0656262505002001, 0.0652173913043478, 0.0629306384933395, 0.0637567435017165, 0.0637837837837838, 0.0609903381642512, 0.0594193112761648, 0.0598618572524942, 0.0587711487088157, 0.059375, 0.0619578686493185, 0.0609756097560976, 0.0576576576576577, 0.0497835497835498, 0.0427807486631016, 0.043010752688172, 0.0396039603960396, 0.0504201680672269, 0.075, 0.0/0.0],
30
- 'phob-2-0.8' => [0.10336833040771, 0.10306752822552, 0.102234232862635, 0.099946552645644, 0.0978007181328546, 0.0957662787818767, 0.0927181767648694, 0.0913878363624687, 0.0879921851517884, 0.0834611567265181, 0.0773899848254932, 0.0688196847366398, 0.0604518928624869, 0.0551154559244901, 0.050834879406308, 0.0477522477522478, 0.0438726007171483, 0.0433532404335324, 0.042305053738852, 0.0418748512966928, 0.0399014778325123, 0.0386071158213475, 0.0378787878787879, 0.0366052060737527, 0.0357142857142857, 0.0344218887908208, 0.0331899200983405, 0.0327974276527331, 0.0307432432432432, 0.0307033202427704, 0.0311678558017274, 0.0300120048019208, 0.0294117647058824, 0.0257234726688103, 0.0264835703776361, 0.0264864864864865, 0.0241545893719807, 0.0229574611748818, 0.0230237912509593, 0.0231522707034728, 0.025, 0.0285006195786865, 0.0274390243902439, 0.0234234234234234, 0.0238095238095238, 0.018716577540107, 0.021505376344086, 0.0247524752475248, 0.0336134453781513, 0.05, 0.0/0.0],
31
- 'phob-1' => [0.189416875082269, 0.188798733425688, 0.187119003445534, 0.186618069952518, 0.184998809969059, 0.183175272216368, 0.18173689504862, 0.178471651602301, 0.173068705189687, 0.166212849776954, 0.156364435330306, 0.146373298526944, 0.134995296331138, 0.119743406985032, 0.107213765718068, 0.0987060998151571, 0.0901459124525285, 0.0851336898395722, 0.0844097995545657, 0.083527764815679, 0.0809500727096461, 0.077191235059761, 0.0762076982691811, 0.075208165457964, 0.0743939816104765, 0.0735337029471841, 0.0719512195121951, 0.070242656449553, 0.06841046277666, 0.0680127523910733, 0.0674115456238361, 0.0658991663358476, 0.0656779661016949, 0.0634703196347032, 0.063933626159102, 0.0640473627556512, 0.0613718411552347, 0.0598520511096167, 0.0603975535168196, 0.059449866903283, 0.0601659751037344, 0.0618046971569839, 0.060790273556231, 0.0575539568345324, 0.0496760259179266, 0.0426666666666667, 0.0428571428571429, 0.0396039603960396, 0.0504201680672269, 0.075, 0.0/0.0],
32
- 'phob-2' => [0.106884296432802, 0.106174549772412, 0.105618870924993, 0.10492877683408, 0.103770698038149, 0.102774850720056, 0.101225736746023, 0.0991783073130649, 0.0961967617871896, 0.0911882277967673, 0.0851765050534642, 0.0778482192802536, 0.0702022577610536, 0.06143977191732, 0.0559232296492389, 0.0495378927911275, 0.0439736158305017, 0.0434224598930481, 0.0427616926503341, 0.042230517965469, 0.0399903053805138, 0.0383466135458167, 0.0379746835443038, 0.0367982809562181, 0.0359431596544999, 0.0347242486139481, 0.0335365853658537, 0.0328863346104725, 0.0308517773306506, 0.0308182784272051, 0.0312849162011173, 0.0301707026597856, 0.0296610169491525, 0.026027397260274, 0.0263543191800878, 0.0263724434876211, 0.0240673886883273, 0.0228648285137861, 0.0229357798165138, 0.0230700976042591, 0.024896265560166, 0.0284301606922126, 0.027355623100304, 0.0233812949640288, 0.0237580993520518, 0.0186666666666667, 0.0214285714285714, 0.0247524752475248, 0.0336134453781513, 0.05, 0.0/0.0],
33
- 'bias-mrna' => [0.433808285892922, 0.433569195326641, 0.433953549749274, 0.43349622685416, 0.433556050482554, 0.434016778640304, 0.42787610619469, 0.416422883146433, 0.400291326003195, 0.376082592486378, 0.340843023255814, 0.300129846039696, 0.250117041198502, 0.202474050902886, 0.159676354029062, 0.122878228782288, 0.0966839792249301, 0.077613855035279, 0.069441353216114, 0.0608675373134328, 0.0576690089653501, 0.0560119492158327, 0.0539912167398605, 0.0523771152296535, 0.0512677626079688, 0.0507732710825795, 0.0509146341463415, 0.0507662835249042, 0.0489604292421194, 0.0474672334396033, 0.0491620111731844, 0.0504168320762207, 0.0508474576271186, 0.0506849315068493, 0.0502684236212787, 0.0522066738428418, 0.0523465703971119, 0.0537995965030262, 0.0512232415902141, 0.0488021295474712, 0.0508298755186722, 0.0531520395550062, 0.0547112462006079, 0.0593525179856115, 0.060475161987041, 0.064, 0.0678571428571429, 0.0693069306930693, 0.0756302521008403, 0.05, 0.0/0.0],
34
- 'bias-prot' => [0.689591628549804, 0.689122922494652, 0.688836104513064, 0.68950500315814, 0.688229736113923, 0.685348278622898, 0.680862831858407, 0.669226393629124, 0.652805187482379, 0.628563234872383, 0.591351744186047, 0.547857540345019, 0.497542134831461, 0.441916678515569, 0.394319682959049, 0.359409594095941, 0.333799440671195, 0.316655976053025, 0.308479857556199, 0.297574626865672, 0.290041192149261, 0.284789644012945, 0.282097649186257, 0.279881815739995, 0.277514628030092, 0.278085789320105, 0.277743902439024, 0.278416347381865, 0.276659959758551, 0.275593340417995, 0.274115456238361, 0.268757443429933, 0.26864406779661, 0.265753424657534, 0.267935578330893, 0.263724434876211, 0.260529482551143, 0.255548083389375, 0.258409785932722, 0.266193433895297, 0.266597510373444, 0.279357231149567, 0.276595744680851, 0.26978417266187, 0.285097192224622, 0.272, 0.271428571428571, 0.262376237623762, 0.252100840336134, 0.3, 0.0/0.0],
35
- }
36
- end
37
-
38
-
39
-
40
- it 'finds the minimum of the plateu region of a stringency plot' do
41
- #data = [10,11,12,10,9,8,7,6,5,4.5,4,3.4, 3.2, 3.3, 3.1, 3.0,2.9,2.8,2.8, 2.8, 2.9, 3.4, 2.2, 1.1,0.0,0.0/0.0]
42
- #data = [10,11,12,10,9,8,7,6,5,4.5,4,3.4, 3.2, 3.3, 3.1, 3.0,2.9,2.8,2.8, 2.8, 2.9, 3.4, 2.2, 1.1,0.0]
43
- @data.each do |k,v|
44
- exp = @expected[k]
45
- bkg = Validator::Background.new(v)
46
- start_i = 25
47
- stop_i = 38
48
- ans = bkg.min_mesa(start_i, stop_i)
49
- ans.should be_close(v[exp], 0.01)
50
- # expecting were my best judgement (erring on the min side)
51
- end
52
- end
53
-
54
- # This is where I'd like to go finding the plateau region!
55
- #it 'finds the minimum of the plateu region of a stringency plot' do
56
- # @data.each do |k,v|
57
- # exp = @expected[k]
58
- # bkg = Validator::Background.new(v)
59
- # ans = bkg.quartile_deriv_finder
60
- # ans.should be_close(v[exp], 0.01)
61
- # # expecting were my best judgement (erring on the min side)
62
- # end
63
- #end
64
-
65
-
66
-
67
- end