annotate tools/blast_rbh/blast_rbh.xml @ 32:b662383a4bdc draft

planemo upload for repository https://github.com/peterjc/galaxy_blast/tree/master/tools/blast_rbh commit 39737c01a51469d0cf9920273de6c151ba84048d-dirty
author peterjc
date Thu, 18 May 2017 07:39:37 -0400
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1 <tool id="blast_reciprocal_best_hits" name="BLAST Reciprocal Best Hits (RBH)" version="0.1.11">
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2 <description>from two FASTA files</description>
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3 <requirements>
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4 <requirement type="package" version="1.67">biopython</requirement>
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5 <requirement type="package" version="2.5.0">blast</requirement>
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6 </requirements>
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7 <stdio>
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8 <!-- Anything other than zero is an error -->
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9 <exit_code range="1:" />
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10 <exit_code range=":-1" />
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11 </stdio>
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12 <version_command interpreter="python">
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13 blast_rbh.py --version
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14 </version_command>
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15 <command interpreter="python">
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16 blast_rbh.py "$fasta_a" "$fasta_b"
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17 -a $seq.dbtype
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18 #if $seq.dbtype=="nucl"
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19 -t $seq.nucl_type
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20 #else
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21 -t $seq.prot_type
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22 #end if
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23 $make_nr
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24 -i $identity
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25 -c $q_cover
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26 -o "$output"
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27 </command>
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28 <inputs>
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29 <!-- Galaxy does not have sub-types for protein vs nucletide FASTA -->
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30 <param name="fasta_a" type="data" format="fasta"
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31 label="Genes/proteins from species A"
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32 help="FASTA file, one sequence per gene/protein."/>
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33 <param name="fasta_b" type="data" format="fasta"
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34 label="Genes/proteins from species B"
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35 help="FASTA file, one sequence per gene/protein."/>
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36 <conditional name="seq">
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37 <param name="dbtype" type="select" label="Molecule type of FASTA inputs">
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38 <option value="prot">protein</option>
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39 <option value="nucl">nucleotide</option>
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40 </param>
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41 <when value="prot">
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42 <param name="prot_type" type="select" display="radio" label="Type of BLAST">
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43 <option value="blastp">blastp - Traditional BLASTP to compare a protein query to a protein database</option>
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44 <option value="blastp-fast">blastp-fast - Uses longer words as described by Shiryev et al (2007)</option>
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45 <option value="blastp-short">blastp-short - BLASTP optimized for queries shorter than 30 residues</option>
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46 </param>
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47 </when>
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48 <when value="nucl">
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49 <param name="nucl_type" type="select" display="radio" label="Type of BLAST">
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50 <option value="megablast">megablast - Traditional megablast used to find very similar (e.g., intraspecies or closely related species) sequences</option>
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51 <option value="blastn">blastn - Traditional BLASTN requiring an exact match of 11, for somewhat similar sequences</option>
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52 <option value="blastn-short">blastn-short - BLASTN program optimized for sequences shorter than 50 bases</option>
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53 <option value="dc-megablast">dc-megablast - Discontiguous megablast used to find more distant (e.g., interspecies) sequences</option>
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54 <option value="tblastx">tblastx - TBLASTX program using translated query against translated database (protein level matches)</option>
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55 </param>
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56 </when>
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57 </conditional>
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58 <param name="identity" type="float" value="70" min="0" max="100"
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59 label="Minimum percentage identity for BLAST matches"
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60 help="Default is 70%, use 0 for no filtering." />
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61 <param name="q_cover" type="float" value="50" min="0" max="100"
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62 label="Minimum percentage query coverage for BLAST matches"
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63 help="Default is 50%, use 0 for no filtering." />
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64 <param name="make_nr" type="boolean" checked="false" truevalue="--nr" falsevalue=""
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65 label="Process input FASTA files to collapse identical sequences"
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66 help="i.e. First make the input non-redundant" />
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67 </inputs>
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68 <outputs>
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69 <data name="output" format="tabular" label="BLAST RBH: $fasta_a.name vs $fasta_b.name" />
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70 </outputs>
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71 <tests>
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72 <test>
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73 <param name="fasta_a" value="four_human_proteins.fasta" ftype="fasta"/>
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74 <param name="fasta_b" value="rhodopsin_proteins.fasta" ftype="fasta"/>
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75 <param name="dbtype" value="prot"/>
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76 <param name="nucl_type" value="blastp"/>
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77 <param name="identity" value="0.0"/>
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78 <param name="q_cover" value="0.0"/>
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79 <output name="output" file="rbh_blastp_four_human_vs_rhodopsin_proteins.tabular" ftype="tabular"/>
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80 </test>
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81 <test>
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82 <param name="fasta_a" value="rhodopsin_nucs.fasta" ftype="fasta"/>
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83 <param name="fasta_b" value="three_human_mRNA.fasta" ftype="fasta"/>
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84 <param name="dbtype" value="nucl"/>
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85 <param name="nucl_type" value="megablast"/>
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86 <param name="identity" value="0.0"/>
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87 <param name="q_cover" value="0.0"/>
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88 <output name="output" file="rbh_megablast_rhodopsin_nucs_vs_three_human_mRNA.tabular" ftype="tabular"/>
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89 </test>
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90 <test>
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91 <param name="fasta_a" value="rhodopsin_nucs.fasta" ftype="fasta"/>
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92 <param name="fasta_b" value="three_human_mRNA.fasta" ftype="fasta"/>
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93 <param name="dbtype" value="nucl"/>
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94 <param name="nucl_type" value="megablast"/>
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95 <param name="identity" value="92"/>
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96 <param name="q_cover" value="86"/>
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97 <output name="output" file="rbh_megablast_rhodopsin_nucs_vs_three_human_mRNA.tabular" ftype="tabular"/>
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98 </test>
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99 <!-- push the percentage identity over the 92.07% level -->
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100 <test>
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101 <param name="fasta_a" value="rhodopsin_nucs.fasta" ftype="fasta"/>
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102 <param name="fasta_b" value="three_human_mRNA.fasta" ftype="fasta"/>
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103 <param name="dbtype" value="nucl"/>
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104 <param name="nucl_type" value="megablast"/>
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105 <param name="identity" value="92.5"/>
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106 <param name="q_cover" value="86"/>
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107 <output name="output" file="rbh_none.tabular" ftype="tabular"/>
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108 </test>
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109 <!-- push the coverage over the 86% level -->
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110 <test>
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111 <param name="fasta_a" value="rhodopsin_nucs.fasta" ftype="fasta"/>
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112 <param name="fasta_b" value="three_human_mRNA.fasta" ftype="fasta"/>
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113 <param name="dbtype" value="nucl"/>
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114 <param name="nucl_type" value="megablast"/>
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115 <param name="identity" value="92"/>
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116 <param name="q_cover" value="87"/>
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117 <output name="output" file="rbh_none.tabular" ftype="tabular"/>
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118 </test>
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119 <test>
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120 <param name="fasta_a" value="rhodopsin_nucs.fasta" ftype="fasta"/>
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121 <param name="fasta_b" value="three_human_mRNA.fasta" ftype="fasta"/>
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122 <param name="dbtype" value="nucl"/>
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123 <param name="nucl_type" value="tblastx"/>
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124 <param name="identity" value="0.0"/>
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125 <param name="q_cover" value="0.0"/>
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126 <output name="output" file="rbh_tblastx_rhodopsin_nucs_vs_three_human_mRNA.tabular" ftype="tabular"/>
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127 </test>
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128 <test>
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129 <param name="fasta_a" value="three_human_mRNA.fasta" ftype="fasta"/>
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130 <param name="fasta_b" value="rhodopsin_nucs.fasta" ftype="fasta"/>
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131 <param name="dbtype" value="nucl"/>
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132 <param name="nucl_type" value="blastn"/>
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133 <param name="identity" value="0.0"/>
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134 <param name="q_cover" value="0.0"/>
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135 <output name="output" file="rbh_blastn_three_human_mRNA_vs_rhodopsin_nucs.tabular" ftype="tabular"/>
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136 </test>
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137 <!-- this pair of examples test tied best hits -->
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138 <test>
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139 <param name="fasta_a" value="k12_ten_proteins.fasta" ftype="fasta"/>
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140 <param name="fasta_b" value="k12_edited_proteins.fasta" ftype="fasta"/>
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141 <param name="dbtype" value="prot"/>
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142 <param name="nucl_type" value="blastp"/>
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143 <param name="identity" value="0.0"/>
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144 <param name="q_cover" value="0.0"/>
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145 <output name="output" file="rbh_blastp_k12.tabular" ftype="tabular"/>
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146 </test>
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147 <test>
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148 <param name="fasta_a" value="k12_edited_proteins.fasta" ftype="fasta"/>
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149 <param name="fasta_b" value="k12_ten_proteins.fasta" ftype="fasta"/>
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150 <param name="dbtype" value="prot"/>
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151 <param name="nucl_type" value="blastp"/>
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152 <param name="identity" value="0.0"/>
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153 <param name="q_cover" value="0.0"/>
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154 <output name="output" file="rbh_blastp_k12.tabular" ftype="tabular"/>
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155 </test>
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156 <!-- this tests self-comparison -->
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157 <test>
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158 <param name="fasta_a" value="k12_edited_proteins.fasta" ftype="fasta"/>
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159 <param name="fasta_b" value="k12_edited_proteins.fasta" ftype="fasta"/>
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160 <param name="dbtype" value="prot"/>
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161 <param name="nucl_type" value="blastp-fast"/>
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162 <param name="identity" value="80.0"/>
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163 <param name="q_cover" value="80.0"/>
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164 <output name="output" file="rbh_blastp_k12_self.tabular" ftype="tabular"/>
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165 </test>
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166 </tests>
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167 <help>
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168 **What it does**
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169
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170 Takes two FASTA files (*species A* and *species B*), builds a BLAST database
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171 for each, runs reciprocal BLAST searchs (*A vs B*, and *B vs A*), optionally
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172 filters the HSPs, and then compiles a list of the reciprocal best hits (RBH).
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173
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174 The output from this tool is a tabular file containing multiple columns, with
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175 information about the BLAST matches used:
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176
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177 ====== ==================================
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178 Column Description
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179 ------ ----------------------------------
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180 1 ID from *species A*
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181 2 ID from *species B*
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182 3 Length of sequence *A*
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183 4 Length of sequence *B*
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184 5 Percentage of sequence *A* covered
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185 6 Percentage of sequence *B* covered
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186 7 HSP alignment length
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187 8 HSP percentage identity
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188 9 HSP bitscore
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189 ====== ==================================
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190
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191 These values correspond to the ``qseqid``/``sseqid``, ``qlen``/``slen``,
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192 ``qcovhsp``, ``length``, ``pident`` and ``bitscore`` values in the BLAST+
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193 tabular output.
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194
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195 For the alignment length, bitscore and percentage identity the values for
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196 *A vs B* and *B vs A* are typically the same, so their minimum is shown.
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197 The coverage values are given by the HSP alignment length divided by the
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198 sequence length (adjusted by a factor of three for TBLASTX).
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199
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200 Note that if a sequence has equally scoring top BLAST matches to multiple
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201 sequence in the other file, it will not be considered for an RBH. This
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202 can happen following gene duplication, or for (near) identical gene
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203 duplicates.
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204
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205 The tool can optionally make the FASTA files non-redundant by replacing
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206 repeated identical sequences with a single representative before building
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207 the databases and running BLAST.
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208
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209 Finally, the tool can be run using the same FASTA input file to look for
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210 RBH within the dataset. In this case, self matches are discarded.
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211
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212 .. class:: warningmark
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213
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214 **Note**
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215
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216 If you are trying to use BLAST RBH matches to identify candidate orthologues
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217 or transfer annotation, you *must* use a percentage identity and minimum
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218 coverage threshold or similiar. See:
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219
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220 Punta and Ofran (2008) The Rough Guide to In Silico Function Prediction,
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221 or How To Use Sequence and Structure Information To Predict Protein
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222 Function. PLoS Comput Biol 4(10): e1000160.
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223 http://dx.doi.org/10.1371/journal.pcbi.1000160
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224
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225 The defaults are to require 70% sequence identity over the aligned region
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226 (using ``pident`` in the BLAST+ tabular output), and that the HSP alignment
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227 covers at least 50% of the query sequence (using ``qcovhsp`` in the BLAST+
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228 tabular output).
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229
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230
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231 **References**
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232
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233 Please cite:
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234
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235 P.J.A. Cock, J.M. Chilton, B. Gruening, J.E. Johnson, N. Soranzo (2015).
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236 NCBI BLAST+ integrated into Galaxy.
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237 *GigaScience* 4:39
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238 http://dx.doi.org/10.1186/s13742-015-0080-7
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239
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240 Christiam Camacho et al. (2009).
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241 BLAST+: architecture and applications.
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242 *BMC Bioinformatics* 15;10:421.
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243 http://dx.doi.org/10.1186/1471-2105-10-421
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244
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245 This wrapper is available to install into other Galaxy Instances via the Galaxy
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246 Tool Shed at http://toolshed.g2.bx.psu.edu/view/peterjc/blast_rbh
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247 </help>
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248 <citations>
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249 <citation type="doi">10.1186/1471-2105-10-421</citation>
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250 <citation type="doi">10.1186/s13742-015-0080-7</citation>
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251 </citations>
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252 </tool>