bioroebe 0.10.80 → 0.12.24
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- checksums.yaml +4 -4
- data/README.md +3946 -2817
- data/bin/bioroebe +13 -2
- data/bin/bioroebe_hash +7 -0
- data/bin/codon_to_aminoacid +6 -4
- data/bin/compacter +7 -0
- data/bin/plain_palindrome +7 -0
- data/bioroebe.gemspec +3 -3
- data/doc/README.gen +3918 -2793
- data/doc/quality_control/commandline_applications.md +3 -3
- data/doc/statistics/statistics.md +7 -7
- data/doc/todo/bioroebe_GUI_todo.md +19 -14
- data/doc/todo/bioroebe_java_todo.md +22 -0
- data/doc/todo/bioroebe_todo.md +2075 -2620
- data/lib/bioroebe/C++/DNA.cpp +69 -0
- data/lib/bioroebe/C++/RNA.cpp +58 -0
- data/lib/bioroebe/C++/sequence.cpp +35 -0
- data/lib/bioroebe/abstract/README.md +1 -0
- data/lib/bioroebe/abstract/features.rb +29 -0
- data/lib/bioroebe/aminoacids/aminoacid_substitution.rb +1 -9
- data/lib/bioroebe/aminoacids/codon_percentage.rb +1 -9
- data/lib/bioroebe/aminoacids/deduce_aminoacid_sequence.rb +1 -9
- data/lib/bioroebe/aminoacids/display_aminoacid_table.rb +1 -0
- data/lib/bioroebe/aminoacids/show_hydrophobicity.rb +1 -6
- data/lib/bioroebe/base/base_module/base_module.rb +36 -0
- data/lib/bioroebe/base/colours_for_base/colours_for_base.rb +18 -8
- data/lib/bioroebe/base/commandline_application/commandline_application.rb +13 -9
- data/lib/bioroebe/base/commandline_application/commandline_arguments.rb +24 -19
- data/lib/bioroebe/base/commandline_application/misc.rb +66 -49
- data/lib/bioroebe/base/commandline_application/opn.rb +8 -8
- data/lib/bioroebe/base/commandline_application/reset.rb +5 -3
- data/lib/bioroebe/base/internal_hash_module/internal_hash_module.rb +42 -0
- data/lib/bioroebe/base/misc.rb +35 -0
- data/lib/bioroebe/base/prototype/misc.rb +15 -9
- data/lib/bioroebe/base/prototype/reset.rb +10 -0
- data/lib/bioroebe/cleave_and_digest/digestion.rb +10 -2
- data/lib/bioroebe/cleave_and_digest/trypsin.rb +104 -50
- data/lib/bioroebe/codon_tables/frequencies/parse_frequency_table.rb +2 -10
- data/lib/bioroebe/codons/codons.rb +1 -1
- data/lib/bioroebe/codons/convert_this_codon_to_that_aminoacid.rb +208 -59
- data/lib/bioroebe/codons/possible_codons_for_this_aminoacid.rb +1 -9
- data/lib/bioroebe/codons/show_codon_tables.rb +8 -3
- data/lib/bioroebe/codons/show_codon_usage.rb +15 -4
- data/lib/bioroebe/colours/rev.rb +4 -1
- data/lib/bioroebe/constants/aminoacids_and_proteins.rb +1 -0
- data/lib/bioroebe/constants/database_constants.rb +1 -1
- data/lib/bioroebe/constants/files_and_directories.rb +31 -4
- data/lib/bioroebe/constants/misc.rb +20 -0
- data/lib/bioroebe/constants/nucleotides.rb +7 -0
- data/lib/bioroebe/conversions/dna_to_aminoacid_sequence.rb +109 -39
- data/lib/bioroebe/count/count_amount_of_aminoacids.rb +3 -2
- data/lib/bioroebe/count/count_amount_of_nucleotides.rb +3 -0
- data/lib/bioroebe/cpp +1 -0
- data/lib/bioroebe/crystal/README.md +2 -0
- data/lib/bioroebe/crystal/to_rna.cr +19 -0
- data/lib/bioroebe/data/README.md +11 -8
- data/lib/bioroebe/data/electron_microscopy/pos_example.pos +396 -0
- data/lib/bioroebe/data/electron_microscopy/test_particles.star +36 -0
- data/lib/bioroebe/data/fasta/human/Homo_sapiens_hemoglobin_subunit_alpha_HBB_mRNA.fasta +9 -0
- data/lib/bioroebe/data/fasta/human/Homo_sapiens_hemoglobin_subunit_beta_HBB_mRNA.fasta +8 -0
- data/lib/bioroebe/data/fasta/human/README.md +2 -0
- data/lib/bioroebe/dotplots/advanced_dotplot.rb +1 -1
- data/lib/bioroebe/electron_microscopy/coordinate_analyzer.rb +15 -18
- data/lib/bioroebe/{fasta_and_fastq/parse_fasta/run.rb → electron_microscopy/electron_microscopy_module.rb} +16 -8
- data/lib/bioroebe/electron_microscopy/fix_pos_file.rb +1 -9
- data/lib/bioroebe/electron_microscopy/flipy.rb +83 -0
- data/lib/bioroebe/electron_microscopy/parse_coordinates.rb +2 -10
- data/lib/bioroebe/electron_microscopy/read_file_xmd.rb +1 -9
- data/lib/bioroebe/electron_microscopy/simple_star_file_generator.rb +4 -9
- data/lib/bioroebe/enzymes/has_this_restriction_enzyme.rb +10 -3
- data/lib/bioroebe/enzymes/restriction_enzyme.rb +23 -1
- data/lib/bioroebe/enzymes/restriction_enzymes/statistics.rb +65 -0
- data/lib/bioroebe/fasta_and_fastq/autocorrect_the_name_of_this_fasta_file.rb +1 -9
- data/lib/bioroebe/fasta_and_fastq/compact_fasta_file/compact_fasta_file.rb +7 -9
- data/lib/bioroebe/fasta_and_fastq/fasta_defline/fasta_defline.rb +1 -5
- data/lib/bioroebe/fasta_and_fastq/fasta_to_yaml/fasta_to_yaml.rb +81 -0
- data/lib/bioroebe/fasta_and_fastq/parse_fasta/parse_fasta.rb +1518 -7
- data/lib/bioroebe/fasta_and_fastq/return_fasta_subsection_of_this_file.rb +11 -2
- data/lib/bioroebe/fasta_and_fastq/show_fasta_headers.rb +27 -12
- data/lib/bioroebe/fasta_and_fastq/simplify_fasta_header/simplify_fasta_header.rb +1 -5
- data/lib/bioroebe/fasta_and_fastq/split_this_fasta_file_into_chromosomes/constants.rb +0 -5
- data/lib/bioroebe/genome/README.md +4 -0
- data/lib/bioroebe/genome/genome.rb +130 -0
- data/lib/bioroebe/genomes/genome_pattern.rb +3 -9
- data/lib/bioroebe/gui/gtk +1 -0
- data/lib/bioroebe/gui/gtk3/alignment/alignment.rb +106 -137
- data/lib/bioroebe/gui/gtk3/aminoacid_composition/aminoacid_composition.rb +27 -61
- data/lib/bioroebe/gui/gtk3/aminoacid_composition/customized_dialog.rb +1 -1
- data/lib/bioroebe/gui/gtk3/blosum_matrix_viewer/blosum_matrix_viewer.rb +1 -2
- data/lib/bioroebe/gui/gtk3/calculate_cell_numbers_of_bacteria/calculate_cell_numbers_of_bacteria.rb +1 -2
- data/lib/bioroebe/gui/gtk3/controller/controller.rb +46 -29
- data/lib/bioroebe/gui/gtk3/dna_to_aminoacid_widget/dna_to_aminoacid_widget.rb +77 -52
- data/lib/bioroebe/gui/gtk3/dna_to_reverse_complement_widget/dna_to_reverse_complement_widget.rb +1 -2
- data/lib/bioroebe/gui/gtk3/fasta_table_widget/fasta_table_widget.rb +100 -23
- data/lib/bioroebe/gui/gtk3/format_converter/format_converter.rb +1 -2
- data/lib/bioroebe/gui/gtk3/gene/gene.rb +1 -2
- data/lib/bioroebe/gui/gtk3/hamming_distance/hamming_distance.rb +43 -30
- data/lib/bioroebe/gui/gtk3/levensthein_distance/levensthein_distance.rb +1 -2
- data/lib/bioroebe/gui/gtk3/nucleotide_analyser/nucleotide_analyser.rb +120 -73
- data/lib/bioroebe/gui/gtk3/primer_design_widget/primer_design_widget.rb +1 -2
- data/lib/bioroebe/gui/gtk3/protein_to_DNA/protein_to_DNA.rb +19 -20
- data/lib/bioroebe/gui/gtk3/random_sequence/random_sequence.rb +20 -13
- data/lib/bioroebe/gui/gtk3/restriction_enzymes/restriction_enzymes.rb +1 -2
- data/lib/bioroebe/gui/gtk3/show_codon_table/misc.rb +97 -22
- data/lib/bioroebe/gui/gtk3/show_codon_table/show_codon_table.rb +3 -73
- data/lib/bioroebe/gui/gtk3/show_codon_usage/show_codon_usage.rb +1 -2
- data/lib/bioroebe/gui/gtk3/sizeseq/sizeseq.rb +1 -2
- data/lib/bioroebe/gui/gtk3/three_to_one/three_to_one.rb +1 -2
- data/lib/bioroebe/gui/gtk3/www_finder/www_finder.rb +1 -2
- data/lib/bioroebe/gui/javafx/bioroebe/Bioroebe.class +0 -0
- data/lib/bioroebe/gui/javafx/bioroebe/Bioroebe.java +104 -0
- data/lib/bioroebe/gui/javafx/bioroebe.jar +0 -0
- data/lib/bioroebe/gui/javafx/bioroebe.mf +1 -0
- data/lib/bioroebe/gui/javafx/module-info.class +0 -0
- data/lib/bioroebe/gui/javafx/module-info.java +5 -0
- data/lib/bioroebe/gui/jruby/alignment/alignment.rb +165 -0
- data/lib/bioroebe/gui/jruby/aminoacid_composition/aminoacid_composition.rb +166 -0
- data/lib/bioroebe/gui/libui/alignment/alignment.rb +3 -1
- data/lib/bioroebe/gui/libui/controller/controller.rb +116 -0
- data/lib/bioroebe/gui/libui/random_sequence/random_sequence.rb +18 -2
- data/lib/bioroebe/gui/libui/show_codon_table/show_codon_table.rb +2 -0
- data/lib/bioroebe/gui/libui/three_to_one/three_to_one.rb +8 -6
- data/lib/bioroebe/gui/shared_code/alignment/alignment_module.rb +102 -0
- data/lib/bioroebe/gui/shared_code/aminoacid_composition/aminoacid_composition_module.rb +94 -0
- data/lib/bioroebe/gui/shared_code/levensthein_distance/levensthein_distance_module.rb +18 -16
- data/lib/bioroebe/gui/shared_code/protein_to_DNA/protein_to_DNA_module.rb +14 -14
- data/lib/bioroebe/gui/swing/three_to_one/ThreeToOne$1.class +0 -0
- data/lib/bioroebe/gui/swing/three_to_one/ThreeToOne$CloseListener.class +0 -0
- data/lib/bioroebe/gui/swing/three_to_one/ThreeToOne.class +0 -0
- data/lib/bioroebe/gui/swing/three_to_one/ThreeToOne.java +141 -0
- data/lib/bioroebe/images/FORWARD_PRIMER.png +0 -0
- data/lib/bioroebe/images/REVERSE_PRIMER.png +0 -0
- data/lib/bioroebe/images/images.html +29845 -0
- data/lib/bioroebe/java/README.md +5 -0
- data/lib/bioroebe/java/bioroebe/AllInOne.java +1 -0
- data/lib/bioroebe/java/bioroebe/Base.class +0 -0
- data/lib/bioroebe/java/bioroebe/Base.java +39 -5
- data/lib/bioroebe/java/bioroebe/IsPalindrome.java +23 -5
- data/lib/bioroebe/java/bioroebe/SanitizeNucleotideSequence.java +0 -0
- data/lib/bioroebe/java/bioroebe/Sequence.java +28 -3
- data/lib/bioroebe/java/bioroebe/ToCamelcase.class +0 -0
- data/lib/bioroebe/java/bioroebe/ToCamelcase.java +16 -4
- data/lib/bioroebe/java/bioroebe/ToRNA.java +43 -0
- data/lib/bioroebe/java/bioroebe/ToplevelMethods.java +6 -0
- data/lib/bioroebe/java/bioroebe/{BisulfiteTreatment.class → src/BisulfiteTreatment.class} +0 -0
- data/lib/bioroebe/java/bioroebe/{Codons.class → src/Codons.class} +0 -0
- data/lib/bioroebe/java/bioroebe/src/Codons.java +35 -0
- data/lib/bioroebe/java/bioroebe/src/Commandline.class +0 -0
- data/lib/bioroebe/java/bioroebe/src/Commandline.java +101 -0
- data/lib/bioroebe/java/bioroebe/{Esystem.class → src/Esystem.class} +0 -0
- data/lib/bioroebe/java/bioroebe/{Esystem.java → src/Esystem.java} +6 -1
- data/lib/bioroebe/java/bioroebe/{GenerateRandomDnaSequence.class → src/GenerateRandomDnaSequence.class} +0 -0
- data/lib/bioroebe/java/bioroebe/{GenerateRandomDnaSequence.java → src/GenerateRandomDnaSequence.java} +8 -2
- data/lib/bioroebe/java/bioroebe/src/PartnerNucleotide.class +0 -0
- data/lib/bioroebe/java/bioroebe/src/PartnerNucleotide.java +56 -0
- data/lib/bioroebe/java/bioroebe/{RemoveFile.java → src/RemoveFile.java} +10 -4
- data/lib/bioroebe/java/bioroebe/{RemoveNumbers.class → src/RemoveNumbers.class} +0 -0
- data/lib/bioroebe/java/bioroebe/{RemoveNumbers.java → src/RemoveNumbers.java} +1 -0
- data/lib/bioroebe/java/bioroebe/src/toplevel_methods/BaseComposition.class +0 -0
- data/lib/bioroebe/java/bioroebe/src/toplevel_methods/BaseComposition.java +75 -0
- data/lib/bioroebe/misc/ruler.rb +11 -2
- data/lib/bioroebe/nucleotides/most_likely_nucleotide_sequence_for_this_aminoacid_sequence.rb +1 -9
- data/lib/bioroebe/nucleotides/sanitize_nucleotide_sequence.rb +59 -18
- data/lib/bioroebe/nucleotides/show_nucleotide_sequence.rb +7 -7
- data/lib/bioroebe/parsers/genbank_parser.rb +347 -26
- data/lib/bioroebe/parsers/gff.rb +1 -9
- data/lib/bioroebe/patterns/scan_for_repeat.rb +1 -5
- data/lib/bioroebe/pdb/fetch_fasta_sequence_from_pdb.rb +1 -9
- data/lib/bioroebe/pdb/parse_mmCIF_file.rb +1 -9
- data/lib/bioroebe/pdb/parse_pdb_file.rb +4 -10
- data/lib/bioroebe/project/project.rb +1 -1
- data/lib/bioroebe/python/README.md +1 -0
- data/lib/bioroebe/python/__pycache__/mymodule.cpython-39.pyc +0 -0
- data/lib/bioroebe/python/gui/gtk3/all_in_one.css +4 -0
- data/lib/bioroebe/python/gui/gtk3/all_in_one.py +59 -0
- data/lib/bioroebe/python/gui/gtk3/widget1.py +20 -0
- data/lib/bioroebe/python/gui/tkinter/all_in_one.py +91 -0
- data/lib/bioroebe/python/mymodule.py +8 -0
- data/lib/bioroebe/python/protein_to_dna.py +33 -0
- data/lib/bioroebe/python/shell/shell.py +19 -0
- data/lib/bioroebe/python/to_rna.py +14 -0
- data/lib/bioroebe/python/toplevel_methods/convert_dna_to_aminoacid_sequence.py +137 -0
- data/lib/bioroebe/python/toplevel_methods/esystem.py +12 -0
- data/lib/bioroebe/python/toplevel_methods/open_in_browser.py +20 -0
- data/lib/bioroebe/python/toplevel_methods/palindromes.py +52 -0
- data/lib/bioroebe/python/toplevel_methods/rds.py +13 -0
- data/lib/bioroebe/python/toplevel_methods/shuffleseq.py +23 -0
- data/lib/bioroebe/python/toplevel_methods/three_delimiter.py +37 -0
- data/lib/bioroebe/python/toplevel_methods/time_and_date.py +43 -0
- data/lib/bioroebe/python/toplevel_methods/to_camelcase.py +21 -0
- data/lib/bioroebe/requires/require_cleave_and_digest.rb +3 -1
- data/lib/bioroebe/requires/require_the_bioroebe_project.rb +3 -1
- data/lib/bioroebe/sequence/alignment.rb +14 -4
- data/lib/bioroebe/sequence/dna.rb +1 -0
- data/lib/bioroebe/sequence/nucleotide_module/nucleotide_module.rb +28 -25
- data/lib/bioroebe/sequence/protein.rb +105 -3
- data/lib/bioroebe/sequence/rna.rb +220 -0
- data/lib/bioroebe/sequence/sequence.rb +128 -40
- data/lib/bioroebe/shell/menu.rb +3815 -3696
- data/lib/bioroebe/shell/misc.rb +9019 -3133
- data/lib/bioroebe/shell/readline/readline.rb +1 -1
- data/lib/bioroebe/shell/shell.rb +1137 -28
- data/lib/bioroebe/siRNA/siRNA.rb +81 -1
- data/lib/bioroebe/string_matching/find_longest_substring.rb +3 -2
- data/lib/bioroebe/string_matching/hamming_distance.rb +1 -9
- data/lib/bioroebe/taxonomy/class_methods.rb +3 -8
- data/lib/bioroebe/taxonomy/constants.rb +4 -3
- data/lib/bioroebe/taxonomy/edit.rb +2 -1
- data/lib/bioroebe/taxonomy/help/help.rb +10 -10
- data/lib/bioroebe/taxonomy/help/helpline.rb +2 -2
- data/lib/bioroebe/taxonomy/info/check_available.rb +15 -9
- data/lib/bioroebe/taxonomy/info/info.rb +18 -11
- data/lib/bioroebe/taxonomy/info/is_dna.rb +46 -36
- data/lib/bioroebe/taxonomy/interactive.rb +140 -104
- data/lib/bioroebe/taxonomy/menu.rb +27 -18
- data/lib/bioroebe/taxonomy/parse_fasta.rb +3 -1
- data/lib/bioroebe/taxonomy/shared.rb +1 -0
- data/lib/bioroebe/taxonomy/taxonomy.rb +1 -0
- data/lib/bioroebe/toplevel_methods/aminoacids_and_proteins.rb +31 -24
- data/lib/bioroebe/toplevel_methods/colourize_related_methods.rb +164 -0
- data/lib/bioroebe/toplevel_methods/databases.rb +1 -1
- data/lib/bioroebe/toplevel_methods/digest.rb +18 -8
- data/lib/bioroebe/toplevel_methods/fasta_and_fastq.rb +107 -63
- data/lib/bioroebe/toplevel_methods/file_and_directory_related_actions.rb +14 -2
- data/lib/bioroebe/toplevel_methods/frequencies.rb +8 -1
- data/lib/bioroebe/toplevel_methods/misc.rb +175 -11
- data/lib/bioroebe/toplevel_methods/nucleotides.rb +118 -46
- data/lib/bioroebe/toplevel_methods/open_in_browser.rb +2 -0
- data/lib/bioroebe/toplevel_methods/palindromes.rb +75 -47
- data/lib/bioroebe/toplevel_methods/taxonomy.rb +3 -3
- data/lib/bioroebe/toplevel_methods/to_camelcase.rb +5 -0
- data/lib/bioroebe/utility_scripts/align_open_reading_frames.rb +1 -9
- data/lib/bioroebe/utility_scripts/check_for_mismatches/check_for_mismatches.rb +1 -9
- data/lib/bioroebe/utility_scripts/compacter/compacter.rb +251 -0
- data/lib/bioroebe/utility_scripts/compseq/compseq.rb +1 -9
- data/lib/bioroebe/utility_scripts/consensus_sequence.rb +6 -6
- data/lib/bioroebe/utility_scripts/create_batch_entrez_file.rb +1 -9
- data/lib/bioroebe/utility_scripts/dot_alignment.rb +1 -9
- data/lib/bioroebe/utility_scripts/move_file_to_its_correct_location.rb +1 -4
- data/lib/bioroebe/utility_scripts/parse_taxonomy.rb +2 -2
- data/lib/bioroebe/utility_scripts/permutations.rb +36 -9
- data/lib/bioroebe/utility_scripts/showorf/constants.rb +0 -5
- data/lib/bioroebe/utility_scripts/showorf/reset.rb +1 -4
- data/lib/bioroebe/version/version.rb +2 -2
- data/lib/bioroebe/www/embeddable_interface.rb +121 -58
- data/lib/bioroebe/www/sinatra/sinatra.rb +186 -71
- data/lib/bioroebe/yaml/aminoacids/amino_acids_long_name_to_one_letter.yml +2 -2
- data/lib/bioroebe/yaml/aminoacids/weight_of_common_proteins.yml +17 -17
- data/lib/bioroebe/yaml/configuration/browser.yml +1 -1
- data/lib/bioroebe/yaml/configuration/temp_dir.yml +1 -1
- data/lib/bioroebe/yaml/consensus_sequences/consensus_sequences.yml +1 -0
- data/lib/bioroebe/yaml/genomes/README.md +3 -4
- data/lib/bioroebe/yaml/nucleotides/nucleotides.yml +5 -0
- data/lib/bioroebe/yaml/restriction_enzymes/restriction_enzymes.yml +57 -57
- data/spec/README.md +6 -0
- data/spec/project_wide_specification/classes.md +5 -0
- metadata +107 -70
- data/doc/setup.rb +0 -1655
- data/lib/bioroebe/fasta_and_fastq/parse_fasta/constants.rb +0 -50
- data/lib/bioroebe/fasta_and_fastq/parse_fasta/initialize.rb +0 -86
- data/lib/bioroebe/fasta_and_fastq/parse_fasta/menu.rb +0 -117
- data/lib/bioroebe/fasta_and_fastq/parse_fasta/misc.rb +0 -981
- data/lib/bioroebe/fasta_and_fastq/parse_fasta/report.rb +0 -156
- data/lib/bioroebe/fasta_and_fastq/parse_fasta/reset.rb +0 -128
- data/lib/bioroebe/genbank/genbank_parser.rb +0 -291
- data/lib/bioroebe/java/bioroebe/AllInOne.class +0 -0
- data/lib/bioroebe/java/bioroebe/Cat.class +0 -0
- data/lib/bioroebe/java/bioroebe/Codons.java +0 -22
- data/lib/bioroebe/java/bioroebe/IsPalindrome.class +0 -0
- data/lib/bioroebe/java/bioroebe/PartnerNucleotide.class +0 -0
- data/lib/bioroebe/java/bioroebe/PartnerNucleotide.java +0 -19
- data/lib/bioroebe/java/bioroebe/SanitizeNucleotideSequence.class +0 -0
- data/lib/bioroebe/java/bioroebe/ToplevelMethods.class +0 -0
- data/lib/bioroebe/java/bioroebe.jar +0 -0
- data/lib/bioroebe/shell/add.rb +0 -108
- data/lib/bioroebe/shell/assign.rb +0 -360
- data/lib/bioroebe/shell/chop_and_cut.rb +0 -281
- data/lib/bioroebe/shell/constants.rb +0 -166
- data/lib/bioroebe/shell/download.rb +0 -335
- data/lib/bioroebe/shell/enable_and_disable.rb +0 -158
- data/lib/bioroebe/shell/enzymes.rb +0 -310
- data/lib/bioroebe/shell/fasta.rb +0 -345
- data/lib/bioroebe/shell/gtk.rb +0 -76
- data/lib/bioroebe/shell/history.rb +0 -132
- data/lib/bioroebe/shell/initialize.rb +0 -217
- data/lib/bioroebe/shell/loop.rb +0 -74
- data/lib/bioroebe/shell/prompt.rb +0 -107
- data/lib/bioroebe/shell/random.rb +0 -289
- data/lib/bioroebe/shell/reset.rb +0 -335
- data/lib/bioroebe/shell/scan_and_parse.rb +0 -135
- data/lib/bioroebe/shell/search.rb +0 -337
- data/lib/bioroebe/shell/sequences.rb +0 -200
- data/lib/bioroebe/shell/show_report_and_display.rb +0 -2901
- data/lib/bioroebe/shell/startup.rb +0 -127
- data/lib/bioroebe/shell/taxonomy.rb +0 -14
- data/lib/bioroebe/shell/tk.rb +0 -23
- data/lib/bioroebe/shell/user_input.rb +0 -88
- data/lib/bioroebe/shell/xorg.rb +0 -45
- data/lib/bioroebe/utility_scripts/compacter.rb +0 -131
- /data/lib/bioroebe/java/bioroebe/{BisulfiteTreatment.java → src/BisulfiteTreatment.java} +0 -0
- /data/lib/bioroebe/java/bioroebe/{RemoveFile.class → src/RemoveFile.class} +0 -0
@@ -2,15 +2,1526 @@
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# Encoding: UTF-8
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# frozen_string_literal: true
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# =========================================================================== #
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# === Bioroebe::ParseFasta
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#
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# This class will parse through a local FASTA file and find the
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# proper entries.
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#
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# A FASTA file may have nucleotides or an aminoacid-sequence, so
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# we have to keep this in mind when parsing it.
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#
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# Usage examples:
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#
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# Bioroebe::ParseFasta.new(ARGV)
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# Bioroebe.parse_fasta(ARGV)
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#
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# =========================================================================== #
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# require 'bioroebe/fasta_and_fastq/parse_fasta/parse_fasta.rb'
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# Bioroebe
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# Bioroebe.parse_fasta
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# Bioroebe.sizeseq
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# =========================================================================== #
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require 'bioroebe/base/commandline_application/commandline_application.rb'
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module Bioroebe
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class ParseFasta < ::Bioroebe::CommandlineApplication # === Bioroebe::ParseFasta
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require 'bioroebe/sequence/dna.rb'
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require 'bioroebe/calculate/calculate_gc_content.rb'
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# ========================================================================= #
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# === REGEX_NON_NUCLEOTIDES
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#
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# All non-nucleotides will be handled here via this regex.
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#
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# N is excluded because it may stand for "any" nucleotide too, at
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# the least for a purine.
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# ========================================================================= #
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REGEX_NON_NUCLEOTIDES =
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/BDEFHIJKLMOPQRSVWXYZ/
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# ========================================================================= #
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# === DEFAULT_FASTA
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#
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# This String can be used to quickly test code depending on FASTA
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# entries.
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# ========================================================================= #
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DEFAULT_FASTA = '>Rosalind_6404
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CCTGCGGAAGATCGGCACTAGAATAGCCAGAACCGTTTCTCTGAGGCTTCCGGCCTTCCC
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TCCCACTAATAATTCTGAGG
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>Rosalind_5959
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CCATCGGTAGCGCATCCTTAGTCCAATTAAGTCCCTATCCAGGCGCTCCGCCGAAGGTCT
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ATATCCATTTGTCAGCAGACACGC
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>Rosalind_0808
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CCACCCTCGTGGTATGGCTAGGCATTCAGGAACCGGAGAACGCTTCAGACCAGCCCGGAC
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TGGGAACCTGCGGGCAGTAGGTGGAAT'
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# ========================================================================= #
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# === DEFAULT_ROUND_TO
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# ========================================================================= #
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DEFAULT_ROUND_TO = 2
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# ========================================================================= #
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# === initialize
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# ========================================================================= #
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def initialize(
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i = DEFAULT_FASTA,
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run_already = true,
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&block
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)
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reset
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# ======================================================================= #
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# === Handle blocks next
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# ======================================================================= #
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if block_given?
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yielded = yield
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# ===================================================================== #
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# First handle Symbols.
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# ===================================================================== #
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case yielded
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# ===================================================================== #
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# === :be_verbose
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# ===================================================================== #
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when :be_verbose,
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:verbose
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set_be_verbose_and_report_the_sequence
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# ===================================================================== #
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# === :be_quiet
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# ===================================================================== #
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when :be_quiet,
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:be_silent
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be_quiet
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# ===================================================================== #
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# === :sizeseq
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# ===================================================================== #
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when :sizeseq
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@sort_by_size = true
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end
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# ===================================================================== #
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# === Handle Hashes next
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# ===================================================================== #
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if yielded.is_a? Hash
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# =================================================================== #
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# === :be_verbose
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# =================================================================== #
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if yielded.has_key? :be_verbose
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set_be_verbose(yielded.delete(:be_verbose))
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@internal_hash[:report_the_sequence] = true
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end
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# =================================================================== #
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# === :use_colours
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# =================================================================== #
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if yielded.has_key? :use_colours
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set_use_colours(
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yielded.delete(:use_colours)
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)
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end
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# =================================================================== #
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# === :sizeseq
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# =================================================================== #
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if yielded.has_key? :sizeseq
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@sort_by_size = true
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end
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end
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end
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set_commandline_arguments(i)
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case run_already
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# ======================================================================= #
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# === :dont_run_yet
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# ======================================================================= #
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when :dont_run_yet,
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:do_not_run_yet
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run_already = false
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end
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run if run_already
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end
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# ========================================================================= #
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# === reset (reset tag)
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# ========================================================================= #
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def reset
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super()
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infer_the_namespace
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# ======================================================================= #
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# === @is_a_genbank_file
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# ======================================================================= #
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@is_a_genbank_file = false
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# ======================================================================= #
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# === @input_file
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#
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# This variable denotes which input file is used to read data from.
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#
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# It is nil initially because we may skip reading from an existing
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# file and e. g. only read from a String or some other non-file
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# entity.
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# ======================================================================= #
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@input_file = nil
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# ======================================================================= #
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# === @hash
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#
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# This is the main variable for the class. It will keep entries such
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# as this one here:
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#
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# {
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# "ENSMUSG00000020122|ENSMUST08" => "CCCTCC"
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# }
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#
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# ======================================================================= #
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@hash = {}
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# ======================================================================= #
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# === @internal_hash
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#
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# This Hash exists for internal configuration of the class.
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# ======================================================================= #
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@internal_hash = {}
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# ======================================================================= #
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# === :report_the_sequence
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# ======================================================================= #
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@internal_hash[:report_the_sequence] = false
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# ======================================================================= #
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# === :overwrite_the_original_file
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# ======================================================================= #
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@internal_hash[:overwrite_the_original_file] = false
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# ======================================================================= #
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# === :save_the_file
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# ======================================================================= #
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@internal_hash[:save_the_file] = false
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# ======================================================================= #
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# === :remove_numbers_from_input
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# ======================================================================= #
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@internal_hash[:remove_numbers_from_input] = false
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# ======================================================================= #
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# === :sanitize_the_file
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#
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# If the following variable is true then the .fasta file at hand will
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# be modified.
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# ======================================================================= #
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@internal_hash[:sanitize_the_file] = false
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# ======================================================================= #
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# === :show_the_translated_protein_sequence
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#
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# This setting is false initially. If set to true via the commandline
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# then report() will show the translated protein sequence as well.
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# ======================================================================= #
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@internal_hash[:show_the_translated_protein_sequence] = false
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# ======================================================================= #
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# === :condense_the_sequence_onto_a_single_line
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#
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# By default the output of this class will include newlines for the
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# sequence. If this is not wanted by the user then the following
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# variable keeps track of that behaviour. You can use the flag
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# called --one-line to enable a condensed output, with newlines
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# being removed.
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# ======================================================================= #
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@internal_hash[:condense_the_sequence_onto_a_single_line] = false
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# ======================================================================= #
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# === :limit_the_display_to_n_nucleotides
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#
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# If this variable is a number rather than nil, then it will be used
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# to display only a limited number of nucleotides, e. g. "1000" if
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# the user passes in 1000.
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# ======================================================================= #
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@internal_hash[:limit_the_display_to_n_nucleotides] = nil
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# ======================================================================= #
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# === @may_we_exit
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# ======================================================================= #
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@may_we_exit = false
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# ======================================================================= #
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# === @current_key
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# ======================================================================= #
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@current_key = nil
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# ======================================================================= #
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# === @use_opn
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# ======================================================================= #
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@use_opn = ::Bioroebe.use_opn?
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# ======================================================================= #
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# === @colourize_sequence
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# ======================================================================= #
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@colourize_sequence = false
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# ======================================================================= #
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# === @sort_by_size
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#
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# If the following variable is set to true, then this class will
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# run a sizeseq-comparison, that is, it will compare all sequences
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# and output them in a size-sorted manner, similar to the EMBOSS
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# sizeseq action.
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# ======================================================================= #
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@sort_by_size = false
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# ======================================================================= #
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# === @show_the_header
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#
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# If this variable is true then the header will be shown.
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# ======================================================================= #
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@show_the_header = false
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set_round_to :default
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set_be_verbose
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end
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# ========================================================================= #
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# === menu (menu tag)
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# ========================================================================= #
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def menu(
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i = return_commandline_arguments_that_are_not_files
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)
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if i.is_a? Array
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i.each {|entry| menu(entry) }
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else
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case i # case tag
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# ===================================================================== #
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# === --sanitize-the-file
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#
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# This entry point allows the user to quickly sanitize a .fasta file.
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#
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# In this context, the default actions done will be to remove all
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# ' ' in a given line, and to upcase the content. Other than that
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# no modifications will be made.
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# ===================================================================== #
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when /^-?-?sanitize(-|_)?the(-|_)?file$/i
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@internal_hash[:sanitize_the_file] = true
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# ===================================================================== #
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# === --to-protein
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#
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# A few aliases exist to this, such as --convert and --translate.
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#
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# Invocation example:
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#
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# pfasta *.fasta --toprotein
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#
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# ===================================================================== #
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when /^-?-?to(-|_)?protein$/i,
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/^-?-?convert$/i,
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/^-?-?translate$/i
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@internal_hash[:show_the_translated_protein_sequence] = true
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# ===================================================================== #
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# === --one-line
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#
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# Invocation example:
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#
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# pfasta rpoS_NC_000913.3.fasta --one-line
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#
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# ===================================================================== #
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when /^-?-?one(-|_)?liner?/i
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@internal_hash[:condense_the_sequence_onto_a_single_line] = true
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# ===================================================================== #
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# === --limit=1000
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#
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# Invocation example:
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#
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# pfasta --limit=1000
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#
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# ===================================================================== #
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when /^-?-?limit=(\d+)$/i
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@internal_hash[:limit_the_display_to_n_nucleotides] = $1.to_s.dup.to_i
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# ===================================================================== #
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# === --overwrite
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# ===================================================================== #
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when /^-?-?overwrite/i
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@internal_hash[:overwrite_the_original_file] = true
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# ===================================================================== #
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# === --help
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#
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# Usage example:
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#
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# parse_fasta --help
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#
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# ===================================================================== #
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when /^-?-?help/i
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show_help
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exit
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# ===================================================================== #
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# === --save-file
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# ===================================================================== #
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when /^-?-?save(-|_)?file/i
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@internal_hash[:save_the_file] = true
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# ===================================================================== #
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# === --also-show-the-sequence
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#
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# To invoke this method try:
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#
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# parsefasta /Depot/Bioroebe/NP_013521.3_289_aa.fasta --show
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#
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# ===================================================================== #
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when /^-?-?also(-|_)?show(-|_)?the(-|_)?sequence$/i,
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/^-?-?report$/i,
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/^-?-?show$/i
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@internal_hash[:report_the_sequence] = true
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# ===================================================================== #
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# === --header
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# ===================================================================== #
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when /^-?-?header/i
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do_show_the_header
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# ===================================================================== #
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# === --short
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#
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# This entry point can be used to show 300 nucleotides and not
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# more, by simply using the --short commandline flag.
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# ===================================================================== #
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when /^-?-?short/i
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@internal_hash[:limit_the_display_to_n_nucleotides] = 300
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# ===================================================================== #
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# === --size
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#
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# This will simply tell us how many nucleotides the given sequence
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# has, then exit.
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#
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# To invoke this method try:
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#
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# parsefasta /Depot/Bioroebe/NP_013521.3_289_aa.fasta --size
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#
|
371
|
+
# ===================================================================== #
|
372
|
+
when /^-?-?size$/i
|
373
|
+
set_be_quiet
|
374
|
+
do_process_the_commandline_arguments_that_are_files
|
375
|
+
erev size? # Report the size here.
|
376
|
+
exit
|
377
|
+
end
|
378
|
+
end
|
379
|
+
end
|
380
|
+
|
381
|
+
# ========================================================================= #
|
382
|
+
# === show_the_translated_protein_sequence?
|
383
|
+
# ========================================================================= #
|
384
|
+
def show_the_translated_protein_sequence?
|
385
|
+
@internal_hash[:show_the_translated_protein_sequence]
|
386
|
+
end
|
387
|
+
|
388
|
+
# ========================================================================= #
|
389
|
+
# === set_round_to
|
390
|
+
#
|
391
|
+
# This will set to how many decimal numbers we will round to. This is
|
392
|
+
# mostly done for display-purposes, hence why the default is a fairly
|
393
|
+
# low value.
|
394
|
+
# ========================================================================= #
|
395
|
+
def set_round_to(
|
396
|
+
i = :default
|
397
|
+
)
|
398
|
+
case i
|
399
|
+
# ======================================================================= #
|
400
|
+
# === :default
|
401
|
+
#
|
402
|
+
# Since as of April 2021, the new default is 2, for rounding.
|
403
|
+
# ======================================================================= #
|
404
|
+
when :default
|
405
|
+
i = DEFAULT_ROUND_TO
|
406
|
+
end
|
407
|
+
@internal_hash[:round_to] = i.to_i
|
408
|
+
end
|
409
|
+
|
410
|
+
# ========================================================================= #
|
411
|
+
# === do_process_the_commandline_arguments_that_are_files
|
412
|
+
# ========================================================================= #
|
413
|
+
def do_process_the_commandline_arguments_that_are_files(
|
414
|
+
these_files = commandline_arguments_that_are_files?
|
415
|
+
)
|
416
|
+
unless these_files.is_a? Array
|
417
|
+
these_files = [these_files].flatten.compact
|
418
|
+
end
|
419
|
+
these_files.each {|this_file|
|
420
|
+
set_input_file(this_file)
|
421
|
+
set_data # This will use the default file.
|
422
|
+
split_into_proper_sections
|
423
|
+
report_the_FASTA_header if @show_the_header
|
424
|
+
if @sort_by_size
|
425
|
+
run_sizeseq_comparison
|
426
|
+
else
|
427
|
+
# =================================================================== #
|
428
|
+
# === Handle cases where the input is a protein
|
429
|
+
# =================================================================== #
|
430
|
+
if is_the_sequence_a_polypeptide?
|
431
|
+
if be_verbose?
|
432
|
+
erev "This sequence is assumed to be a #{royalblue('protein')}#{rev}."
|
433
|
+
report_how_many_elements_we_have_found
|
434
|
+
end
|
435
|
+
else # Must be a protein.
|
436
|
+
# =================================================================== #
|
437
|
+
# === Else it must be RNA or DNA
|
438
|
+
# =================================================================== #
|
439
|
+
if be_verbose?
|
440
|
+
erev "This sequence is assumed to "\
|
441
|
+
"be #{royalblue('DNA')}#{rev} or #{royalblue('RNA')}#{rev}."
|
442
|
+
end
|
443
|
+
calculate_gc_content # GC content makes only sense for nucleotides.
|
444
|
+
report_how_many_elements_we_have_found if be_verbose?
|
445
|
+
end
|
446
|
+
if be_verbose?
|
447
|
+
report_the_nucleotide_composition
|
448
|
+
report_on_how_many_entries_we_did_work
|
449
|
+
if report_the_sequence?
|
450
|
+
do_report_the_sequence
|
451
|
+
end
|
452
|
+
end
|
453
|
+
end
|
454
|
+
}
|
455
|
+
end
|
456
|
+
|
457
|
+
# ========================================================================= #
|
458
|
+
# === sanitize_the_description
|
459
|
+
#
|
460
|
+
# This method will iterate over the description entry and sanitize
|
461
|
+
# it. In this context sanitizing means to add the "length" entry,
|
462
|
+
# and the "type" entry, such as in:
|
463
|
+
#
|
464
|
+
# " # length=231; type=dna"
|
465
|
+
#
|
466
|
+
# ========================================================================= #
|
467
|
+
def sanitize_the_description
|
468
|
+
@data.map! {|line|
|
469
|
+
if line.start_with?('>') and !line.include?('length=')
|
470
|
+
length = 0
|
471
|
+
if @hash.has_key? line.delete('>')
|
472
|
+
length = @hash[line.delete('>')].size
|
473
|
+
end
|
474
|
+
line << " # length=#{length}; type=dna" # Currently hardcoded to DNA.
|
475
|
+
end
|
476
|
+
line
|
477
|
+
}
|
478
|
+
end
|
479
|
+
|
480
|
+
# ========================================================================= #
|
481
|
+
# === entries?
|
482
|
+
# ========================================================================= #
|
483
|
+
def entries?
|
484
|
+
@data
|
485
|
+
end
|
486
|
+
|
487
|
+
# ========================================================================= #
|
488
|
+
# === we_may_exit
|
489
|
+
# ========================================================================= #
|
490
|
+
def we_may_exit
|
491
|
+
@may_we_exit = true
|
492
|
+
end
|
493
|
+
|
494
|
+
# ========================================================================= #
|
495
|
+
# === output_results
|
496
|
+
# ========================================================================= #
|
497
|
+
def output_results
|
498
|
+
pp @hash
|
499
|
+
end
|
500
|
+
|
501
|
+
# ========================================================================= #
|
502
|
+
# === do_report_the_sequence (report tag)
|
503
|
+
#
|
504
|
+
# This method is used to display the main sequence at hand.
|
505
|
+
# ========================================================================= #
|
506
|
+
def do_report_the_sequence
|
507
|
+
_ = main_sequence?
|
508
|
+
# ======================================================================= #
|
509
|
+
# Honour the --limit commandline flag next.
|
510
|
+
# ======================================================================= #
|
511
|
+
if @internal_hash[:limit_the_display_to_n_nucleotides]
|
512
|
+
_ = _[0 .. (@internal_hash[:limit_the_display_to_n_nucleotides] - 1)]
|
513
|
+
end
|
514
|
+
if @colourize_sequence
|
515
|
+
if is_polynucleotide?
|
516
|
+
# =================================================================== #
|
517
|
+
# Else assume this is DNA/RNA input.
|
518
|
+
# =================================================================== #
|
519
|
+
_.gsub!(/A/, teal('A')+rev)
|
520
|
+
_.gsub!(/C/, slateblue('C')+rev)
|
521
|
+
_.gsub!(/G/, royalblue('G')+rev)
|
522
|
+
_.gsub!(/T/, steelblue('T')+rev)
|
523
|
+
_.gsub!(/U/, steelblue('U')+rev)
|
524
|
+
#else
|
525
|
+
end
|
526
|
+
end
|
527
|
+
if condense_the_sequence_onto_a_single_line?
|
528
|
+
_ = _.delete("\n")
|
529
|
+
end
|
530
|
+
erev colourize_this_nucleotide_sequence(_)
|
531
|
+
e if condense_the_sequence_onto_a_single_line?
|
532
|
+
if show_the_translated_protein_sequence?
|
533
|
+
# ===================================================================== #
|
534
|
+
# Do show the translated protein sequence next:
|
535
|
+
# ===================================================================== #
|
536
|
+
translated_into_aa = Bioroebe.to_aa(_)
|
537
|
+
translated_into_aa_and_colourized = translated_into_aa.dup
|
538
|
+
if translated_into_aa.include? '*'
|
539
|
+
translated_into_aa_and_colourized = translated_into_aa.gsub(/\*/,tomato('*'))
|
540
|
+
end
|
541
|
+
erev 'The translated aminoacid sequence of '+
|
542
|
+
sfancy(translated_into_aa.size.to_s)+rev+
|
543
|
+
' aminoacids is:'
|
544
|
+
e
|
545
|
+
erev steelblue(" #{translated_into_aa_and_colourized}")
|
546
|
+
e
|
547
|
+
end
|
548
|
+
end; alias display do_report_the_sequence # === display
|
549
|
+
alias report do_report_the_sequence # === report
|
550
|
+
|
551
|
+
# ========================================================================= #
|
552
|
+
# === report_the_nucleotide_composition
|
553
|
+
# ========================================================================= #
|
554
|
+
def report_the_nucleotide_composition
|
555
|
+
if is_this_sequence_a_polynucleotide_sequence?
|
556
|
+
first = @hash.values.first.upcase
|
557
|
+
total_size = first.size
|
558
|
+
n_adenines = first.count('A')
|
559
|
+
n_thymidines = first.count('T')
|
560
|
+
n_cytodines = first.count('C')
|
561
|
+
n_guanines = first.count('G')
|
562
|
+
erev "The nucleotide composition is as follows:"
|
563
|
+
e " "\
|
564
|
+
"#{steelblue(n_adenines)}#{rev}x A (#{(n_adenines * 100.0 / total_size).round(2)}%), "\
|
565
|
+
"#{steelblue(n_thymidines)}#{rev}x T (#{(n_thymidines * 100.0 / total_size).round(2)}%), "\
|
566
|
+
"#{steelblue(n_cytodines)}#{rev}x C (#{(n_cytodines * 100.0 / total_size).round(2)}%), "\
|
567
|
+
"#{steelblue(n_guanines)}#{rev}x G (#{(n_guanines * 100.0 / total_size).round(2)}%)"
|
568
|
+
elsif is_a_protein?
|
569
|
+
# ===================================================================== #
|
570
|
+
# Report the composition of the protein:
|
571
|
+
# ===================================================================== #
|
572
|
+
sequence = @hash.values.first.delete("\n")
|
573
|
+
erev "The protein composition (aminoacids) is as follows:"
|
574
|
+
# e colourize_this_aminoacid_sequence_for_the_commandline(" #{sequence}")
|
575
|
+
e orchid(" #{sequence}")
|
576
|
+
end
|
577
|
+
end; alias report_the_protein_composition report_the_nucleotide_composition # === report_the_protein_composition
|
578
|
+
|
579
|
+
# ========================================================================= #
|
580
|
+
# === report_how_many_elements_we_have_found
|
581
|
+
# ========================================================================= #
|
582
|
+
def report_how_many_elements_we_have_found
|
583
|
+
if @hash
|
584
|
+
first = @hash.values.first.delete("\n")
|
585
|
+
size = first.size.to_s
|
586
|
+
if be_verbose?
|
587
|
+
n_start_codons = first.count('ATG')
|
588
|
+
# =================================================================== #
|
589
|
+
# We upcase it since as of October 2021, as some FASTA files may
|
590
|
+
# include the sequence in lowercased characters.
|
591
|
+
# =================================================================== #
|
592
|
+
n_start_codons += first.reverse.upcase.count('ATG')
|
593
|
+
result = "This sequence contains #{simp(size.to_s)}#{rev}"\
|
594
|
+
" #{nucleotides_or_aminoacids?}".dup
|
595
|
+
if is_a_nucleotide?
|
596
|
+
result << " and #{n_start_codons} "\
|
597
|
+
"ATG codons (on both strands) in total"
|
598
|
+
end
|
599
|
+
result << '.'
|
600
|
+
if size.to_i > 1_000_000
|
601
|
+
# ================================================================= #
|
602
|
+
# Format the number with '_' characters.
|
603
|
+
# ================================================================= #
|
604
|
+
formatted = size.to_i.to_s.reverse.split(/(.{3})/).reject(&:empty?).join('_').reverse
|
605
|
+
result = result.dup if result.frozen?
|
606
|
+
result << ' ('+simp(formatted+' bp')+rev+')'
|
607
|
+
end
|
608
|
+
erev result
|
609
|
+
end
|
610
|
+
end
|
611
|
+
end
|
612
|
+
|
613
|
+
# ========================================================================= #
|
614
|
+
# === report_on_how_many_entries_we_did_work
|
615
|
+
# ========================================================================= #
|
616
|
+
def report_on_how_many_entries_we_did_work
|
617
|
+
if be_verbose?
|
618
|
+
entry_or_entries = 'entry'
|
619
|
+
if @hash.keys.size > 1
|
620
|
+
entry_or_entries = 'entries'
|
621
|
+
end
|
622
|
+
erev "We have identified a total of #{orange(@hash.keys.size)}"\
|
623
|
+
"#{rev} #{entry_or_entries} in this fasta dataset."
|
624
|
+
e
|
625
|
+
end
|
626
|
+
end
|
627
|
+
|
628
|
+
# ========================================================================= #
|
629
|
+
# === report_the_FASTA_header
|
630
|
+
# ========================================================================= #
|
631
|
+
def report_the_FASTA_header
|
632
|
+
e "#{rev}The header is: #{steelblue(header?)}"
|
633
|
+
end
|
634
|
+
|
635
|
+
# ========================================================================= #
|
636
|
+
# === report_the_sequence?
|
637
|
+
# ========================================================================= #
|
638
|
+
def report_the_sequence?
|
639
|
+
@internal_hash[:report_the_sequence]
|
640
|
+
end
|
641
|
+
|
642
|
+
# ========================================================================= #
|
643
|
+
# === sanitize_data
|
644
|
+
# ========================================================================= #
|
645
|
+
def sanitize_data(i)
|
646
|
+
if i.is_a? Array
|
647
|
+
i.flatten!
|
648
|
+
i.reject! {|entry| entry.start_with? '#' }
|
649
|
+
i.reject! {|entry| entry.strip.empty? }
|
650
|
+
if i.first and i.first.include? "\r"
|
651
|
+
# =================================================================== #
|
652
|
+
# Some FASTA files include "\r" line endings. We will check first
|
653
|
+
# for the first entry to contain a \r, and if so, we assume the
|
654
|
+
# whole FASTA file may have \r, which then will be removed.
|
655
|
+
# =================================================================== #
|
656
|
+
i.map! {|entry| entry.delete("\r") }
|
657
|
+
end
|
658
|
+
end
|
659
|
+
# ========================================================================= #
|
660
|
+
# === Run through SanitizeNucleotideSequence
|
661
|
+
# ========================================================================= #
|
662
|
+
if @internal_hash[:remove_numbers_from_input]
|
663
|
+
i = Bioroebe::SanitizeNucleotideSequence[i]
|
664
|
+
end
|
665
|
+
i
|
666
|
+
end
|
667
|
+
|
668
|
+
# ========================================================================= #
|
669
|
+
# === current_key?
|
670
|
+
# ========================================================================= #
|
671
|
+
def current_key?
|
672
|
+
@current_key
|
673
|
+
end; alias id? current_key? # === id?
|
674
|
+
alias sequence_id? current_key? # === sequence_id?
|
675
|
+
alias title current_key? # === title
|
676
|
+
alias title? current_key? # === title?
|
677
|
+
|
678
|
+
# ========================================================================= #
|
679
|
+
# === round_to?
|
680
|
+
# ========================================================================= #
|
681
|
+
def round_to?
|
682
|
+
@internal_hash[:round_to]
|
683
|
+
end
|
684
|
+
|
685
|
+
# ========================================================================= #
|
686
|
+
# === opnn
|
687
|
+
# ========================================================================= #
|
688
|
+
def opnn
|
689
|
+
super(namespace?) if use_opn?
|
690
|
+
end
|
691
|
+
|
692
|
+
# ========================================================================= #
|
693
|
+
# === use_opn?
|
694
|
+
# ========================================================================= #
|
695
|
+
def use_opn?
|
696
|
+
@use_opn
|
697
|
+
end
|
698
|
+
|
699
|
+
# ========================================================================= #
|
700
|
+
# === calculate_gc_content
|
701
|
+
#
|
702
|
+
# Calculate the gc content through this method, which is called from
|
703
|
+
# within the method run().
|
704
|
+
# ========================================================================= #
|
705
|
+
def calculate_gc_content
|
706
|
+
_ = @hash.values.join.delete(N)
|
707
|
+
if is_polynucleotide? _
|
708
|
+
@hash.each_pair {|key, content|
|
709
|
+
# =================================================================== #
|
710
|
+
# Delegate towards the method Bioroebe.gc_content next, including
|
711
|
+
# to round towards 5 positions:
|
712
|
+
# =================================================================== #
|
713
|
+
gc_content = ::Bioroebe.gc_content(content.upcase, round_to?)
|
714
|
+
gc_content = gc_content.first if gc_content.is_a? Array
|
715
|
+
gc_content = gc_content.to_s
|
716
|
+
minimal_key = key.to_s
|
717
|
+
if minimal_key.include? '|'
|
718
|
+
minimal_key = minimal_key.split('|').last.strip
|
719
|
+
end
|
720
|
+
if be_verbose?
|
721
|
+
_ = minimal_key.strip
|
722
|
+
if _.size > 40 # Shorten the content a bit if it is too long.
|
723
|
+
_ = _[0 .. 40]+' [...]'
|
724
|
+
end
|
725
|
+
erev 'GC content of "'+simp(_)+rev+'" is: '+
|
726
|
+
"#{sfancy(gc_content)}#{rev} %"
|
727
|
+
end
|
728
|
+
}
|
729
|
+
else
|
730
|
+
erev '`'+simp(_)+rev+'` is not a polynucleotide.' if be_verbose?
|
731
|
+
end
|
732
|
+
end
|
733
|
+
|
734
|
+
# ========================================================================= #
|
735
|
+
# === first_value
|
736
|
+
#
|
737
|
+
# This will return the first entry of the Fasta files.
|
738
|
+
# ========================================================================= #
|
739
|
+
def first_value
|
740
|
+
sequences?.first
|
741
|
+
end
|
742
|
+
|
743
|
+
# ========================================================================= #
|
744
|
+
# === nucleotides_or_aminoacids?
|
745
|
+
# ========================================================================= #
|
746
|
+
def nucleotides_or_aminoacids?
|
747
|
+
if is_polynucleotide?
|
748
|
+
'nucleotides'
|
749
|
+
else
|
750
|
+
'aminoacids'
|
751
|
+
end
|
752
|
+
end
|
753
|
+
|
754
|
+
# ========================================================================= #
|
755
|
+
# === is_polynucleotide?
|
756
|
+
# ========================================================================= #
|
757
|
+
def is_polynucleotide?(i = main_sequence?)
|
758
|
+
!is_protein?(i)
|
759
|
+
end; alias is_a_nucleotide? is_polynucleotide? # === is_a_nucleotide?
|
760
|
+
|
761
|
+
# ========================================================================= #
|
762
|
+
# === is_this_sequence_a_polynucleotide_sequence?
|
763
|
+
# ========================================================================= #
|
764
|
+
def is_this_sequence_a_polynucleotide_sequence?
|
765
|
+
!is_protein?
|
766
|
+
end
|
767
|
+
|
768
|
+
# ========================================================================= #
|
769
|
+
# === data?
|
770
|
+
#
|
771
|
+
# This will contain the full content of the (whole) .fasta file, including
|
772
|
+
# the header.
|
773
|
+
# ========================================================================= #
|
774
|
+
def data?
|
775
|
+
@data
|
776
|
+
end; alias input? data? # === input?
|
777
|
+
alias dataset? data? # === dataset?
|
778
|
+
|
779
|
+
# ========================================================================= #
|
780
|
+
# === hash?
|
781
|
+
# ========================================================================= #
|
782
|
+
def hash?
|
783
|
+
@hash
|
784
|
+
end
|
785
|
+
|
786
|
+
# ========================================================================= #
|
787
|
+
# === sequences?
|
788
|
+
#
|
789
|
+
# This method will obtain all found sequences.
|
790
|
+
# ========================================================================= #
|
791
|
+
def sequences?
|
792
|
+
@hash.values
|
793
|
+
end; alias sequences sequences? # === sequences
|
794
|
+
alias values sequences? # === values
|
795
|
+
|
796
|
+
# ========================================================================= #
|
797
|
+
# === short_headers?
|
798
|
+
#
|
799
|
+
# The short-headers are like the headers, but if a ' ' token is found
|
800
|
+
# then the line will be truncated towards that first ' '.
|
801
|
+
#
|
802
|
+
# An example is:
|
803
|
+
#
|
804
|
+
# sp|Q91FT8|234R_IIV6 Uncharacterized protein 234R OS=Invertebrate iridescent virus 6 OX=176652 GN=IIV6-234R PE=4 SV=1
|
805
|
+
#
|
806
|
+
# This will be truncated towards
|
807
|
+
#
|
808
|
+
# sp|Q91FT8|234R_IIV6
|
809
|
+
#
|
810
|
+
# This could then be used to automatically rename FASTA files, for
|
811
|
+
# instance.
|
812
|
+
# ========================================================================= #
|
813
|
+
def short_headers?
|
814
|
+
headers?.map {|entry|
|
815
|
+
if entry.include? ' '
|
816
|
+
entry = entry.split(' ').first
|
817
|
+
end
|
818
|
+
entry
|
819
|
+
}
|
820
|
+
end
|
821
|
+
|
822
|
+
# ========================================================================= #
|
823
|
+
# === set_data
|
824
|
+
#
|
825
|
+
# This is the setter-method towards @data. It is no longer allowed to
|
826
|
+
# invoke set_input_file() since as of 12.06.2020. This means that
|
827
|
+
# you have to invoke that method prior to calling this method.
|
828
|
+
# ========================================================================= #
|
829
|
+
def set_data(i = @input_file)
|
830
|
+
# ======================================================================= #
|
831
|
+
# The next line attempts to ensure that even an Array can be used
|
832
|
+
# as input to that method.
|
833
|
+
# ======================================================================= #
|
834
|
+
i = [i].flatten.compact.first.to_s.dup
|
835
|
+
if File.exist? i.to_s # First try to read in from a file.
|
836
|
+
if be_verbose?
|
837
|
+
opnn; erev "Will read from the file `#{sfile(i)}#{rev}`."
|
838
|
+
end
|
839
|
+
i = File.readlines(i)
|
840
|
+
if @is_a_genbank_file
|
841
|
+
selected = i.select {|line|
|
842
|
+
line.start_with?(' ') and # such as: " 61 atggggcctg caatggggcc tgcaatgggg cctgca\n"
|
843
|
+
(line.strip =~ /\d+/)
|
844
|
+
}.map {|inner_line|
|
845
|
+
inner_line.strip.delete(' 0123456789').strip.upcase
|
846
|
+
}
|
847
|
+
i = ["> genbank file"]+selected
|
848
|
+
end
|
849
|
+
end
|
850
|
+
if i.nil? or i.empty?
|
851
|
+
i = DEFAULT_FASTA
|
852
|
+
opnn; erev 'No input was provided. Thus a default FASTA '\
|
853
|
+
'sequence will be used instead.'
|
854
|
+
end
|
855
|
+
i = sanitize_data(i)
|
856
|
+
i = i.split(N) if i.is_a? String
|
857
|
+
@data = i
|
858
|
+
end; alias set_sequence set_data # === set_Sequence
|
859
|
+
|
860
|
+
# ========================================================================= #
|
861
|
+
# === set_be_verbose_and_report_the_sequence
|
862
|
+
# ========================================================================= #
|
863
|
+
def set_be_verbose_and_report_the_sequence
|
864
|
+
set_be_verbose
|
865
|
+
@internal_hash[:report_the_sequence] = true
|
866
|
+
end
|
867
|
+
|
868
|
+
# ========================================================================= #
|
869
|
+
# === condense_the_sequence_onto_a_single_line?
|
870
|
+
# ========================================================================= #
|
871
|
+
def condense_the_sequence_onto_a_single_line?
|
872
|
+
@internal_hash[:condense_the_sequence_onto_a_single_line]
|
873
|
+
end
|
874
|
+
|
875
|
+
# ========================================================================= #
|
876
|
+
# === return_size_sorted_hash
|
877
|
+
# ========================================================================= #
|
878
|
+
def return_size_sorted_hash(i = @hash)
|
879
|
+
_ = i.sort_by {|key, value| value.size }
|
880
|
+
i = Hash[_]
|
881
|
+
return i
|
882
|
+
end
|
883
|
+
|
884
|
+
# ========================================================================= #
|
885
|
+
# === do_sort_by_size
|
886
|
+
#
|
887
|
+
# This method will sort the hash by size of the sequence. It has been
|
888
|
+
# inspired by the EMBOSS sizeq functionality.
|
889
|
+
#
|
890
|
+
# The output that should be generated might look like this:
|
891
|
+
#
|
892
|
+
# https://www.bioinformatics.nl/cgi-bin/emboss/help/sizeseq#input.1
|
893
|
+
#
|
894
|
+
# Invocation example:
|
895
|
+
#
|
896
|
+
# x = Bioroebe::ParseFasta.new('/Depot/j/globins.fasta'); x.do_sort_by_size
|
897
|
+
#
|
898
|
+
# ========================================================================= #
|
899
|
+
def do_sort_by_size
|
900
|
+
# ======================================================================= #
|
901
|
+
# Sort it here first, by the size of the "value", aka the sequence body.
|
902
|
+
# ======================================================================= #
|
903
|
+
@hash = return_size_sorted_hash(@hash)
|
904
|
+
_ = ''.dup
|
905
|
+
@hash.each_pair {|key, sequence|
|
906
|
+
_ << '> ID '+sequence.size.to_s+' AA.; DE: '+key.to_s+
|
907
|
+
' SQ '+sequence.size.to_s+' AA'+N # ; unknown MW as of yet; '\
|
908
|
+
#'unknown CRC64 as of yet'+N
|
909
|
+
_ << sequence+N+N
|
910
|
+
}
|
911
|
+
e _
|
912
|
+
end; alias run_sizeseq_comparison do_sort_by_size # === run_sizeseq_comparison
|
913
|
+
|
914
|
+
# ========================================================================= #
|
915
|
+
# === n_nucleotides?
|
916
|
+
# ========================================================================= #
|
917
|
+
def n_nucleotides?
|
918
|
+
@hash.values.first.delete("\n").size
|
919
|
+
end; alias return_n_aminoacids n_nucleotides? # === return_n_aminoacids
|
920
|
+
alias size? n_nucleotides? # === size?
|
921
|
+
alias sequence_size? n_nucleotides? # === sequence_size?
|
922
|
+
|
923
|
+
# ========================================================================= #
|
924
|
+
# === headers?
|
925
|
+
# ========================================================================= #
|
926
|
+
def headers?
|
927
|
+
@hash.keys
|
928
|
+
end
|
929
|
+
|
930
|
+
# ========================================================================= #
|
931
|
+
# === first_key?
|
932
|
+
#
|
933
|
+
# Obtain the very first entry.
|
934
|
+
# ========================================================================= #
|
935
|
+
def first_key?
|
936
|
+
headers?.first
|
937
|
+
end
|
938
|
+
|
939
|
+
# ========================================================================= #
|
940
|
+
# === header?
|
941
|
+
#
|
942
|
+
# This variant will always return the first entry.
|
943
|
+
# ========================================================================= #
|
944
|
+
def header?
|
945
|
+
headers?.first.to_s
|
946
|
+
end
|
947
|
+
|
948
|
+
# ========================================================================= #
|
949
|
+
# === raw_body?
|
950
|
+
# ========================================================================= #
|
951
|
+
def raw_body?
|
952
|
+
@hash.values.first
|
953
|
+
end
|
954
|
+
|
955
|
+
# ========================================================================= #
|
956
|
+
# === do_show_the_header
|
957
|
+
# ========================================================================= #
|
958
|
+
def do_show_the_header
|
959
|
+
@show_the_header = true
|
960
|
+
end
|
961
|
+
|
962
|
+
# ========================================================================= #
|
963
|
+
# === set_input_file
|
964
|
+
#
|
965
|
+
# This method will be used to keep track of the input-file, from
|
966
|
+
# which we will read the dataset.
|
967
|
+
# ========================================================================= #
|
968
|
+
def set_input_file(i = nil)
|
969
|
+
if i.nil?
|
970
|
+
# ===================================================================== #
|
971
|
+
# First, we try to find a .fasta or .fa file in the current
|
972
|
+
# directory. If we can find it, we will use that instead.
|
973
|
+
# ===================================================================== #
|
974
|
+
unless Dir['*.{fa,fasta}'].empty?
|
975
|
+
file = Dir['*.{fa,fasta}'].first
|
976
|
+
if be_verbose?
|
977
|
+
result = 'A '
|
978
|
+
if file.end_with? '.fasta'
|
979
|
+
result < 'FASTA '
|
980
|
+
end
|
981
|
+
result << 'file was found in this directory ('+sfile(file)+').'
|
982
|
+
opnn; erev result
|
983
|
+
opnn; erev 'We will use it.'
|
984
|
+
end
|
985
|
+
i = file
|
986
|
+
end
|
987
|
+
unless Dir['*.{fa,fasta}'].empty?
|
988
|
+
file = Dir['*.{fa,fasta}'].first
|
989
|
+
if be_verbose?
|
990
|
+
opnn; erev "We have found a file in this "\
|
991
|
+
"directory (#{sfile(file)}#{rev})."
|
992
|
+
opnn; erev 'We will use it.'
|
993
|
+
end
|
994
|
+
i = file
|
995
|
+
end
|
996
|
+
end
|
997
|
+
if i and File.exist?(i)
|
998
|
+
dataset = File.read(i)
|
999
|
+
if dataset[0 .. ('LOCUS'.size - 1)] == 'LOCUS'
|
1000
|
+
@is_a_genbank_file = true
|
1001
|
+
end
|
1002
|
+
end
|
1003
|
+
@input_file = i
|
1004
|
+
end; alias set_input_files set_input_file # === set_input_files
|
1005
|
+
|
1006
|
+
# ========================================================================= #
|
1007
|
+
# === save_the_file?
|
1008
|
+
# ========================================================================= #
|
1009
|
+
def save_the_file?
|
1010
|
+
@internal_hash[:save_the_file]
|
1011
|
+
end
|
1012
|
+
|
1013
|
+
# ========================================================================= #
|
1014
|
+
# === overwrite_the_original_file?
|
1015
|
+
# ========================================================================= #
|
1016
|
+
def overwrite_the_original_file?
|
1017
|
+
@internal_hash[:overwrite_the_original_file]
|
1018
|
+
end
|
1019
|
+
|
1020
|
+
# ========================================================================= #
|
1021
|
+
# === split_into_proper_sections
|
1022
|
+
#
|
1023
|
+
# Split up into the fasta identifier, and the content.
|
1024
|
+
# ========================================================================= #
|
1025
|
+
def split_into_proper_sections
|
1026
|
+
unless @data.to_s.include? '>'
|
1027
|
+
erev 'No ">" character was found in this dataset.'
|
1028
|
+
erev 'It is recommended to always have a > identifier '\
|
1029
|
+
'for the'
|
1030
|
+
erev 'FASTA format (such as in a .fasta or a .fa file).'
|
1031
|
+
end if be_verbose? # Ok, the input data includes >. We can proceed.
|
1032
|
+
@data.each { |line|
|
1033
|
+
# ===================================================================== #
|
1034
|
+
# === Handle the leading > FASTA identifier first
|
1035
|
+
# ===================================================================== #
|
1036
|
+
if line.start_with? '>' # leading identifier.
|
1037
|
+
@current_key = line[1..-1].chomp # Select all but the first character.
|
1038
|
+
@hash[@current_key] = ''.dup
|
1039
|
+
else
|
1040
|
+
line.delete!('_')
|
1041
|
+
unless @current_key
|
1042
|
+
@current_key = 'standard'
|
1043
|
+
@hash[@current_key] = ''.dup
|
1044
|
+
end
|
1045
|
+
# =================================================================== #
|
1046
|
+
# === Retain the newlines
|
1047
|
+
#
|
1048
|
+
# Here we may decide to get rid of newlines, but it is better to
|
1049
|
+
# NOT remove the newlines - that way we can simply save the
|
1050
|
+
# dataset again.
|
1051
|
+
# @hash[@current_key] << no_newlines(line)
|
1052
|
+
# =================================================================== #
|
1053
|
+
@hash[@current_key] << line
|
1054
|
+
end
|
1055
|
+
}
|
1056
|
+
end
|
1057
|
+
|
1058
|
+
# ========================================================================= #
|
1059
|
+
# === save_into_a_fasta_file
|
1060
|
+
# ========================================================================= #
|
1061
|
+
def save_into_a_fasta_file(
|
1062
|
+
be_verbose = be_verbose?
|
1063
|
+
)
|
1064
|
+
case be_verbose
|
1065
|
+
when :be_verbose
|
1066
|
+
be_verbose = true
|
1067
|
+
end
|
1068
|
+
if @data
|
1069
|
+
what = @data.join("\n")
|
1070
|
+
into = 'standard.fasta'
|
1071
|
+
erev 'Saving into '+sfile(into)+rev+'.' if be_verbose
|
1072
|
+
write_what_into(what, into)
|
1073
|
+
return File.absolute_path(into) # And return the file we saved into.
|
1074
|
+
else
|
1075
|
+
opnn; erev 'No @data variable exists.'
|
1076
|
+
end
|
1077
|
+
end; alias do_save_the_file save_into_a_fasta_file # === do_save_the_file
|
1078
|
+
|
1079
|
+
# ========================================================================= #
|
1080
|
+
# === add_length_information_to_the_header
|
1081
|
+
# ========================================================================= #
|
1082
|
+
def add_length_information_to_the_header
|
1083
|
+
_ = header?.strip
|
1084
|
+
_ << ' length='+sequence_size?.to_s+';'
|
1085
|
+
# ======================================================================= #
|
1086
|
+
# Next, designate where to store this file.
|
1087
|
+
# ======================================================================= #
|
1088
|
+
into = 'new_fasta_file.fasta'
|
1089
|
+
if overwrite_the_original_file?
|
1090
|
+
into = @input_file
|
1091
|
+
end
|
1092
|
+
what = ''.dup
|
1093
|
+
what << "> "+_+"\n"
|
1094
|
+
what << raw_body?
|
1095
|
+
if what and into
|
1096
|
+
erev 'Storing into `'+sfile(into)+rev+'`.'
|
1097
|
+
write_what_into(what, into)
|
1098
|
+
end
|
1099
|
+
end
|
1100
|
+
|
1101
|
+
# ========================================================================= #
|
1102
|
+
# === simplify_header
|
1103
|
+
#
|
1104
|
+
# This method can be called to simplify the header. It will save into
|
1105
|
+
# a .fasta file at once.
|
1106
|
+
# ========================================================================= #
|
1107
|
+
def simplify_header
|
1108
|
+
_ = header?
|
1109
|
+
# ======================================================================= #
|
1110
|
+
# Next, simplify the header. We must start with checking for [] first,
|
1111
|
+
# because if there are any [] in the FASTA header then we can simplify
|
1112
|
+
# stuff at once.
|
1113
|
+
# ======================================================================= #
|
1114
|
+
if _.include?('[') and _.include?(']')
|
1115
|
+
_ = '> '+_.strip.scan(/\[.+\]/).flatten.first.delete('[]')+"\n"
|
1116
|
+
elsif _.include? ','
|
1117
|
+
_ = _[0 .. (_.index(',') - 1) ].strip
|
1118
|
+
end
|
1119
|
+
what = nil
|
1120
|
+
# ======================================================================= #
|
1121
|
+
# Next, designate where to store this file.
|
1122
|
+
# ======================================================================= #
|
1123
|
+
into = 'new_fasta_file.fasta'
|
1124
|
+
if overwrite_the_original_file?
|
1125
|
+
into = @input_file
|
1126
|
+
end
|
1127
|
+
if _.start_with? '>'
|
1128
|
+
what = _
|
1129
|
+
elsif _.include?('[') and _.include?(']') # For example: [Pan troglodytes]
|
1130
|
+
# ===================================================================== #
|
1131
|
+
# See rubular at:
|
1132
|
+
#
|
1133
|
+
# https://rubular.com/r/aDjI0JwMOUlZzP
|
1134
|
+
#
|
1135
|
+
# ===================================================================== #
|
1136
|
+
what = "> "+_.scan(/\[(.+)\]/).flatten.first.to_s+"\n".dup
|
1137
|
+
elsif _.include? 'Human'
|
1138
|
+
_scanned_result = _.scan(/(Human)/)
|
1139
|
+
what = "> "+$1.to_s.dup+"\n".dup
|
1140
|
+
else
|
1141
|
+
erev "Unsure what to do: #{steelblue(_)}"
|
1142
|
+
end
|
1143
|
+
if what and into
|
1144
|
+
what << raw_body?
|
1145
|
+
erev 'Storing into `'+sfile(into)+rev+'`.'
|
1146
|
+
write_what_into(what, into)
|
1147
|
+
end
|
1148
|
+
end
|
1149
|
+
|
1150
|
+
# ========================================================================= #
|
1151
|
+
# === sequence
|
1152
|
+
#
|
1153
|
+
# This method will return the sequence, without any newlines. It is also
|
1154
|
+
# called the "body" of a FASTA file.
|
1155
|
+
# ========================================================================= #
|
1156
|
+
def sequence
|
1157
|
+
_ = @hash.values.first
|
1158
|
+
_.chomp! if _ and _.end_with?(N)
|
1159
|
+
return no_newlines(_)
|
1160
|
+
end; alias fasta_sequence sequence # === fasta_sequence
|
1161
|
+
alias sequence? sequence # === sequence?
|
1162
|
+
alias body? sequence # === body?
|
1163
|
+
alias body sequence # === body?
|
1164
|
+
alias naseq sequence # === naseq
|
1165
|
+
alias nucleotide_sequence sequence # === nucleotide_sequence
|
1166
|
+
alias return_sequence sequence # === return_sequence
|
1167
|
+
alias content? sequence # === content?
|
1168
|
+
|
1169
|
+
# ========================================================================= #
|
1170
|
+
# === save
|
1171
|
+
#
|
1172
|
+
# This method will save our FASTA file.
|
1173
|
+
# ========================================================================= #
|
1174
|
+
def save
|
1175
|
+
if @input_file.nil?
|
1176
|
+
erev "The generic file #{sfile('foobar.fasta')}#{rev} "\
|
1177
|
+
"will be used."
|
1178
|
+
set_input_file('foobar.fasta')
|
1179
|
+
end
|
1180
|
+
into = @input_file
|
1181
|
+
what = @data.join("\n")
|
1182
|
+
erev 'Storing into '+sfile(into)+rev+'.'
|
1183
|
+
write_what_into(what, into)
|
1184
|
+
return into
|
1185
|
+
end
|
1186
|
+
|
1187
|
+
# ========================================================================= #
|
1188
|
+
# === []
|
1189
|
+
#
|
1190
|
+
# This is a simpler query-interface for obtaining the DNA/RNA sequence
|
1191
|
+
# of the FASTA file (or aminoacid sequence, if we have a protein at
|
1192
|
+
# hand here).
|
1193
|
+
#
|
1194
|
+
# Using the method sequences? here, which in turn works on @hash, is
|
1195
|
+
# ok because Hashes are kept in a sorted manner in ruby since some
|
1196
|
+
# time.
|
1197
|
+
# ========================================================================= #
|
1198
|
+
def [](i)
|
1199
|
+
sequences?[i]
|
1200
|
+
end
|
1201
|
+
|
1202
|
+
# ========================================================================= #
|
1203
|
+
# === Bioroebe::ParseFasta[]
|
1204
|
+
# ========================================================================= #
|
1205
|
+
def self.[](i)
|
1206
|
+
_ = new(i)
|
1207
|
+
_.sequences?
|
1208
|
+
end
|
1209
|
+
|
1210
|
+
# ========================================================================= #
|
1211
|
+
# === type?
|
1212
|
+
# ========================================================================= #
|
1213
|
+
def type?
|
1214
|
+
if is_the_sequence_a_polypeptide?
|
1215
|
+
:protein
|
1216
|
+
elsif is_this_sequence_a_polynucleotide_sequence?
|
1217
|
+
:dna_or_rna
|
1218
|
+
else
|
1219
|
+
:unknown
|
1220
|
+
end
|
1221
|
+
end
|
1222
|
+
|
1223
|
+
# ========================================================================= #
|
1224
|
+
# === is_the_sequence_a_polypeptide?
|
1225
|
+
#
|
1226
|
+
# This method can be used to determine whether a given input sequence
|
1227
|
+
# is a polypeptide (aka a protein) or whether it is not.
|
1228
|
+
#
|
1229
|
+
# If this sequence is a polypeptide then this method will return true.
|
1230
|
+
# Otherwise false will be returned.
|
1231
|
+
# ========================================================================= #
|
1232
|
+
def is_the_sequence_a_polypeptide?(
|
1233
|
+
i = main_sequence?
|
1234
|
+
)
|
1235
|
+
return_value = false # Set the default return value here.
|
1236
|
+
# ======================================================================= #
|
1237
|
+
# Look at the first 120 positions to determine whether this is a protein
|
1238
|
+
# or a nucleotide sequence.
|
1239
|
+
# ======================================================================= #
|
1240
|
+
subsequence = i[0 .. 119] # Must deduct 1 at the end since Arrays in ruby start at 0.
|
1241
|
+
# ======================================================================= #
|
1242
|
+
# Build a frequency of the characters there.
|
1243
|
+
# ======================================================================= #
|
1244
|
+
hash = {}
|
1245
|
+
hash.default = 0
|
1246
|
+
subsequence.chars.each {|character|
|
1247
|
+
hash[character] += 1
|
1248
|
+
}
|
1249
|
+
keys_to_check_for = %w(
|
1250
|
+
B D E F H I J K L M O P Q R S V W X Y Z
|
1251
|
+
)
|
1252
|
+
|
1253
|
+
values = hash.select {|key, value|
|
1254
|
+
if keys_to_check_for.include? key
|
1255
|
+
true
|
1256
|
+
else
|
1257
|
+
false
|
1258
|
+
end
|
1259
|
+
}.values.sum
|
1260
|
+
if values > 0
|
1261
|
+
return_value = true
|
1262
|
+
end
|
1263
|
+
return return_value
|
1264
|
+
end; alias is_protein? is_the_sequence_a_polypeptide? # === is_protein?
|
1265
|
+
alias is_a_protein? is_the_sequence_a_polypeptide? # === is_a_protein?
|
1266
|
+
|
1267
|
+
# ========================================================================= #
|
1268
|
+
# === main_sequence?
|
1269
|
+
#
|
1270
|
+
# This will always return the first entry.
|
1271
|
+
# ========================================================================= #
|
1272
|
+
def main_sequence?
|
1273
|
+
@hash.values.first
|
1274
|
+
end
|
1275
|
+
|
1276
|
+
# ========================================================================= #
|
1277
|
+
# === gc_content?
|
1278
|
+
# ========================================================================= #
|
1279
|
+
def gc_content?
|
1280
|
+
return ::Bioroebe.gc_content(main_sequence?).to_f # Must be a float.
|
1281
|
+
end; alias gc_content gc_content? # === gc_content
|
1282
|
+
|
1283
|
+
# ========================================================================= #
|
1284
|
+
# === sequence_object
|
1285
|
+
#
|
1286
|
+
# This method will return a Sequence object.
|
1287
|
+
#
|
1288
|
+
# Usage example:
|
1289
|
+
#
|
1290
|
+
# x = Bioroebe.parse_fasta 'ls_orchid.fasta'
|
1291
|
+
# y = x.sequence_object # y is now an instance of Bioroebe::Sequence
|
1292
|
+
#
|
1293
|
+
# ========================================================================= #
|
1294
|
+
def sequence_object
|
1295
|
+
::Bioroebe::Sequence.new(main_sequence?)
|
1296
|
+
end
|
1297
|
+
|
1298
|
+
# ========================================================================= #
|
1299
|
+
# === sanitize_the_file?
|
1300
|
+
# ========================================================================= #
|
1301
|
+
def sanitize_the_file?
|
1302
|
+
@internal_hash[:sanitize_the_file]
|
1303
|
+
end
|
1304
|
+
|
1305
|
+
# ========================================================================= #
|
1306
|
+
# === show_help (help tag)
|
1307
|
+
#
|
1308
|
+
# This method will inform the user how this class may be used from the
|
1309
|
+
# commandline.
|
1310
|
+
#
|
1311
|
+
# Invocation example:
|
1312
|
+
#
|
1313
|
+
# pfasta --help
|
1314
|
+
#
|
1315
|
+
# ========================================================================= #
|
1316
|
+
def show_help
|
1317
|
+
e
|
1318
|
+
eparse ' --size'
|
1319
|
+
eparse ' --also-show-the-sequence'
|
1320
|
+
eparse ' --header # show the header as well (normally the '\
|
1321
|
+
'header is not shown)'
|
1322
|
+
eparse ' --limit=1000 # limit to show only the first 1000 '\
|
1323
|
+
'nucleotides; use'
|
1324
|
+
eparse ' # any number that you need here'
|
1325
|
+
eparse ' --one-line # show the sequence on one line only, '\
|
1326
|
+
'e. g. all newlines'
|
1327
|
+
eparse ' # were removed'
|
1328
|
+
eparse ' --toprotein # show the protein sequence as well '\
|
1329
|
+
'(assumes DNA or RNA'
|
1330
|
+
eparse ' # .fasta file)'
|
1331
|
+
eparse ' --convert # alias to the above ^^^'
|
1332
|
+
eparse ' --translate # alias to the above ^^^'
|
1333
|
+
eparse ' --sanitize-the-file # delete all " " characters '\
|
1334
|
+
'and upcase the content, of a'
|
1335
|
+
eparse ' # .fasta file'
|
1336
|
+
e
|
1337
|
+
end
|
1338
|
+
|
1339
|
+
# ========================================================================= #
|
1340
|
+
# === do_sanitize_the_file_then_exit
|
1341
|
+
# ========================================================================= #
|
1342
|
+
def do_sanitize_the_file_then_exit
|
1343
|
+
_ = non_hyphened_commandline_arguments?
|
1344
|
+
first = _.first
|
1345
|
+
if File.exist?(first)
|
1346
|
+
dataset = default_readlines(first)
|
1347
|
+
# ===================================================================== #
|
1348
|
+
# Next, iterate over the dataset.
|
1349
|
+
# ===================================================================== #
|
1350
|
+
dataset.map! {|entry|
|
1351
|
+
entry = entry.dup if entry.frozen?
|
1352
|
+
entry.delete!(' ') if entry.include?(' ')
|
1353
|
+
entry.upcase!
|
1354
|
+
entry
|
1355
|
+
}
|
1356
|
+
opne 'Saving the sanitized dataset into '\
|
1357
|
+
'the file '+sfile(first)+rev+'.'
|
1358
|
+
write_what_into(dataset.join, first)
|
1359
|
+
end
|
1360
|
+
exit
|
1361
|
+
end
|
1362
|
+
|
1363
|
+
# ========================================================================= #
|
1364
|
+
# === run (run tag)
|
1365
|
+
# ========================================================================= #
|
1366
|
+
def run
|
1367
|
+
menu
|
1368
|
+
do_sanitize_the_file_then_exit if sanitize_the_file?
|
1369
|
+
do_process_the_commandline_arguments_that_are_files
|
1370
|
+
do_save_the_file if save_the_file?
|
1371
|
+
end
|
1372
|
+
|
1373
|
+
end
|
1374
|
+
|
1375
|
+
Fasta = ParseFasta # Add an "alias" constant to class ParseFasta.
|
1376
|
+
|
1377
|
+
# =========================================================================== #
|
1378
|
+
# === Bioroebe.parse_fasta_quietly
|
1379
|
+
#
|
1380
|
+
# As the variant above, but will work quietly.
|
1381
|
+
# =========================================================================== #
|
1382
|
+
def self.parse_fasta_quietly(
|
1383
|
+
i, use_colours = true
|
1384
|
+
)
|
1385
|
+
::Bioroebe.parse_fasta(i, use_colours) { :be_quiet }
|
1386
|
+
end
|
1387
|
+
|
1388
|
+
# =========================================================================== #
|
1389
|
+
# === Bioroebe.return_fasta_entry_with_the_highest_gc_content
|
1390
|
+
#
|
1391
|
+
# The first argument should be a locally existing FASTA file that
|
1392
|
+
# contains different sequences.
|
1393
|
+
#
|
1394
|
+
# Usage example:
|
1395
|
+
#
|
1396
|
+
# x = Bioroebe.return_fasta_entry_with_the_highest_gc_content('/rosalind_gc.txt')
|
1397
|
+
#
|
1398
|
+
# =========================================================================== #
|
1399
|
+
def self.return_fasta_entry_with_the_highest_gc_content(this_fasta_file)
|
1400
|
+
if File.exist? this_fasta_file
|
1401
|
+
dataset = File.read(this_fasta_file)
|
1402
|
+
dataset = parse_fasta(dataset) { :be_quiet }
|
1403
|
+
hash = dataset.hash?
|
1404
|
+
hash.transform_values! {|this_value|
|
1405
|
+
::Bioroebe.gc_content(this_value).to_f
|
1406
|
+
}
|
1407
|
+
return hash.max_by {|key, value| value }
|
1408
|
+
else
|
1409
|
+
erev "No file exists at #{sfile(this_fasta_file)}#{rev}."
|
1410
|
+
end
|
1411
|
+
end
|
1412
|
+
|
1413
|
+
# =========================================================================== #
|
1414
|
+
# === Bioroebe.sizeseq
|
1415
|
+
#
|
1416
|
+
# This method will "size-sequence compare", typically on a .fasta file.
|
1417
|
+
# =========================================================================== #
|
1418
|
+
def self.sizeseq(i)
|
1419
|
+
if i.is_a? Array
|
1420
|
+
i = i.first
|
1421
|
+
end
|
1422
|
+
_ = Bioroebe.parse_fasta(i) { :be_quiet }
|
1423
|
+
_.do_sort_by_size
|
1424
|
+
end
|
1425
|
+
|
1426
|
+
# =========================================================================== #
|
1427
|
+
# === Bioroebe.return_sizeseq
|
1428
|
+
#
|
1429
|
+
# This is as Bioroebe.sizeseq(), but it will just return the result,
|
1430
|
+
# rather than output it.
|
1431
|
+
# =========================================================================== #
|
1432
|
+
def self.return_sizeseq(i)
|
1433
|
+
if i.is_a? Array
|
1434
|
+
i = i.first
|
1435
|
+
end
|
1436
|
+
_ = Bioroebe.parse_fasta(i) { :be_quiet }
|
1437
|
+
hash = _.return_size_sorted_hash
|
1438
|
+
result = ''.dup
|
1439
|
+
hash.each_pair {|key, sequence|
|
1440
|
+
result << '> ID '+sequence.size.to_s+' AA.; DE: '+key.to_s+
|
1441
|
+
' SQ '+sequence.size.to_s+' AA'+N
|
1442
|
+
result << sequence+N+N
|
1443
|
+
}
|
1444
|
+
return result
|
1445
|
+
end
|
1446
|
+
|
1447
|
+
# =========================================================================== #
|
1448
|
+
# === Bioroebe.genbank_to_fasta
|
1449
|
+
#
|
1450
|
+
# This method will convert from a genbank file, to a .fasta file.
|
1451
|
+
#
|
1452
|
+
# Invocation example:
|
1453
|
+
#
|
1454
|
+
# Bioroebe.genbank_to_fasta('/home/x/DATA/PROGRAMMING_LANGUAGES/RUBY/src/bioroebe/lib/bioroebe/data/genbank/sample_file.genbank')
|
1455
|
+
#
|
1456
|
+
# =========================================================================== #
|
1457
|
+
def self.genbank_to_fasta(
|
1458
|
+
this_file,
|
1459
|
+
be_verbose = :be_verbose
|
1460
|
+
)
|
1461
|
+
case be_verbose
|
1462
|
+
when :be_quiet
|
1463
|
+
be_verbose = false
|
1464
|
+
end
|
1465
|
+
if this_file.is_a? Array
|
1466
|
+
this_file = this_file.first
|
1467
|
+
end
|
1468
|
+
if File.exist? this_file
|
1469
|
+
_ = Bioroebe::ParseFasta.new(this_file) { :be_quiet }
|
1470
|
+
else
|
1471
|
+
_ = Bioroebe::ParseFasta.new(:do_not_run_yet) { :be_quiet }
|
1472
|
+
_.set_data # This will use the default file.
|
1473
|
+
_.split_into_proper_sections
|
1474
|
+
end
|
1475
|
+
file_path = _.save_into_a_fasta_file(be_verbose)
|
1476
|
+
return file_path
|
1477
|
+
end
|
1478
|
+
|
1479
|
+
# =========================================================================== #
|
1480
|
+
# === Bioroebe.parse_fasta_file
|
1481
|
+
# =========================================================================== #
|
1482
|
+
def self.parse_fasta_file(
|
1483
|
+
i = ARGV,
|
1484
|
+
use_colours = true
|
1485
|
+
)
|
1486
|
+
use_this_hash = {
|
1487
|
+
use_colours: use_colours,
|
1488
|
+
be_verbose: false
|
1489
|
+
}
|
1490
|
+
ParseFasta.new(i) { use_this_hash }
|
1491
|
+
end; self.instance_eval { alias fasta_file parse_fasta_file } # === Bioroebe.fasta_file
|
1492
|
+
|
1493
|
+
# =========================================================================== #
|
1494
|
+
# === Bioroebe.parse_fasta
|
1495
|
+
#
|
1496
|
+
# Easier reader-method for .fasta files.
|
1497
|
+
#
|
1498
|
+
# The second argument determines whether we will use colours or whether
|
1499
|
+
# we will not. For now, the default is to not use colours when we use
|
1500
|
+
# this particular class method.
|
1501
|
+
#
|
1502
|
+
# Invocation examples:
|
1503
|
+
#
|
1504
|
+
# x = Bioroebe.parse_fasta('/rosalind_gc.txt')
|
1505
|
+
# hash = Bioroebe.parse_fasta('/rosalind_gc.txt').hash?
|
1506
|
+
#
|
1507
|
+
# =========================================================================== #
|
1508
|
+
def self.parse_fasta(
|
1509
|
+
i,
|
1510
|
+
use_colours = true
|
1511
|
+
)
|
1512
|
+
use_this_hash = {
|
1513
|
+
use_colours: use_colours
|
1514
|
+
}
|
1515
|
+
if block_given?
|
1516
|
+
use_this_hash = {
|
1517
|
+
use_colours: use_colours,
|
1518
|
+
be_verbose: yield
|
1519
|
+
}
|
1520
|
+
end
|
1521
|
+
::Bioroebe::ParseFasta.new(i) { use_this_hash }
|
1522
|
+
end; self.instance_eval { alias fasta parse_fasta } # === Bioroebe.fasta
|
1523
|
+
|
1524
|
+
end
|
14
1525
|
|
15
1526
|
if __FILE__ == $PROGRAM_NAME
|
16
1527
|
Bioroebe::ParseFasta.new(ARGV) { :sizeseq }
|
@@ -24,4 +1535,4 @@ end # corefasta globins.fasta
|
|
24
1535
|
# pfasta /GC.txt
|
25
1536
|
# pfasta 013521.3_289_aa.fasta --also-show-the-sequence
|
26
1537
|
# pfasta $RSRC/bioroebe/lib/bioroebe/data/GFP_mutant_3_coding_sequence.fasta --also-show-the-sequence
|
27
|
-
# corefasta $J/globins.fasta
|
1538
|
+
# corefasta $J/globins.fasta
|