annotate diamond.xml @ 7:62c9df8382c2 draft

"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/diamond commit b2d290a8b609ebbc7f4b93716370143c41062ad4"
author bgruening
date Tue, 03 Dec 2019 17:40:05 -0500
parents 64be1ac21109
children 54f751e413f4
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7
62c9df8382c2 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/diamond commit b2d290a8b609ebbc7f4b93716370143c41062ad4"
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1 <tool id="bg_diamond" name="Diamond" version="@VERSION@.0" profile="19.01">
0
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2 <description>alignment tool for short sequences against a protein database</description>
1
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3 <macros>
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4 <import>macros.xml</import>
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5 </macros>
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6 <expand macro="requirements" />
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7 <expand macro="stdio" />
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8 <expand macro="version_command" />
0
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9 <command>
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10 <![CDATA[
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11
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12 #if $ref_db_source.db_source == "history":
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13 ln -s $ref_db_source.reference_database ./database.dmnd
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14 #else:
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15 ln -s ${ref_db_source.index.fields.db_path} ./database.dmnd
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16 #end if
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17
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18 &&
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19
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20 diamond
6
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21 $method_cond.method_select
0
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22 --threads "\${GALAXY_SLOTS:-12}"
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23 --db ./database
1
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24 --query '$query'
6
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25 #if $method_cond.method_select == "blastx"
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26 --query-gencode '$method_cond.query_gencode'
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27 --strand '$method_cond.query_strand'
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28 --min-orf $method_cond.min_orf
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29 #if $method_cond.frameshift_cond.frameshift_select == 'yes'
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30 --frameshift $method_cond.frameshift_cond.frameshift
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31 $method_cond.frameshift_cond.range_culling
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32 #end if
3
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33 #end if
1
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34
6
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35 @OUTPUT_ARGS@
1
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36
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37 --compress '0'
3
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38 #if $sensitivity == "1"
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39 --sensitive
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40 #else if $sensitivity == "2"
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41 --more-sensitive
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42 #end if
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43
6
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44 #if str($gapopen) != "":
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45 --gapopen '$gapopen'
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46 #end if
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47 #if str($gapextend) != "":
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48 --gapextend '$gapextend'
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49 #end if
1
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50 --matrix '$matrix'
6
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51 --comp-based-stats '$comp_based_stats'
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52 --masking '$masking'
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53
6
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54 @HITFILTER_ARGS@
0
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55
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56 #if str($filter_score.filter_score_select) == 'evalue':
1
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57 --evalue '$filter_score.evalue'
0
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58 #else:
1
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59 --min-score '$filter_score.min_score'
0
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60 #end if
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61
1
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62 --id '$id'
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63 --query-cover '$query_cover'
6
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64 --subject-cover '$subject_cover'
1
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65 --block-size '$block_size'
6
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66 #if str($unal) == '1':
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67 --unal 1 --un '$unalqueries'
6
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68 #end if
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69 $no_self_hits
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70 #if $tax_cond.tax_select == 'file':
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71 --taxonlist `cat '$tax_cond.taxonlistfile' | grep -v "^#" | grep -v "^$" | tr "\n" "," | sed 's/,$//'`
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72 #else if $tax_cond.tax_select == 'list':
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73 --taxonlist '$tax_cond.taxonlist'
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74 #end if
0
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75 ]]>
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76 </command>
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77 <inputs>
6
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78 <conditional name="method_cond">
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79 <param name="method_select" type="select" label="What do you want to align?" help="(blastp/blastx)">
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80 <option value="blastp">Align amino acid query sequences (blastp)</option>
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81 <option value="blastx">Align DNA query sequences (blastx)</option>
3
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82 </param>
6
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83 <when value="blastx">
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84 <param name="query_gencode" argument="--query-gencode" type="select" label="Genetic code used for translation of query in BLASTX mode" help="">
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85 <option value="1">The Standard Code</option>
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86 <option value="2">The Vertebrate Mitochondrial Code</option>
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87 <option value="3">The Yeast Mitochondrial Code</option>
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88 <option value="4">The Mold, Protozoan, and Coelenterate Mitochondrial Code and the Mycoplasma/Spiroplasma Code</option>
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89 <option value="5">The Invertebrate Mitochondrial Code</option>
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90 <option value="6">The Ciliate, Dasycladacean and Hexamita Nuclear Code</option>
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91 <option value="9">The Echinoderm and Flatworm Mitochondrial Code</option>
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92 <option value="10">The Euplotid Nuclear Code</option>
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93 <option value="11">The Bacterial, Archaeal and Plant Plastid Code</option>
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94 <option value="12">The Alternative Yeast Nuclear Code</option>
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95 <option value="13">The Ascidian Mitochondrial Code</option>
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96 <option value="14">The Alternative Flatworm Mitochondrial Code</option>
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97 <option value="16">Chlorophycean Mitochondrial Code</option>
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98 <option value="21">Trematode Mitochondrial Code</option>
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99 <option value="22">Scenedesmus obliquus Mitochondrial Code</option>
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100 <option value="23">Thraustochytrium Mitochondrial Code</option>
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101 <option value="24">Pterobranchia Mitochondrial Code</option>
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102 <option value="25">Candidate Division SR1 and Gracilibacteria Code</option>
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103 <option value="26">Pachysolen tannophilus Nuclear Code</option>
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104 </param>
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105 <param argument="--min-orf" name="min_orf" type="integer" value="1" label="ignore translated sequences without an open reading frame of at least this length" help="By default this feature is disabled for sequences of length below 30, set to 20 for sequences of length below 100, and set to 40 otherwise. Setting this option to 1 will disable this feature" />
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106
6
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107 <param name="query_strand" argument="--strand" type="select" label="query strands to search" help="">
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108 <option value="both" selected="True">Both</option>
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109 <option value="plus">Plus</option>
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110 <option value="minus">Minus</option>
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111 </param>
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112 <conditional name="frameshift_cond">
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113 <param name="frameshift_select" type="select" label="Allow for frameshifts?" help="">
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114 <option value="yes">yes</option>
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115 <option value="no" selected="true">no</option>
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116 </param>
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117 <when value="yes">
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118 <param argument="--range-culling" name="range_culling" type="boolean" truevalue="--range-culling" falsevalue="" checked="false" label="restrict hit culling to overlapping query ranges" help="This feature is designed for long query DNA sequences that may span several genes. In these cases, the default of reporting the 25 best overall hits could cause hits to a lower scoring gene to be overshadowed. But just increasing the number of alignments reported will bloat the output size and reduce performance. Using this feature along with -k 25 (default), a hit will only be deleted if at least 50% of its query range is spanned by at least 25 higher or equal scoring hits. Using this feature along with --top 10, a hit will only be deleted if its score is more than 10% lower than that of a higher scoring hit over at least 50% of its query range. The percentage is configurable using --range-cover. Note that this feature is currently only available in frameshift alignment mode"/>
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119 <param argument="--frameshift" type="integer" value="0" label="frame shift penalty" help="Values around 15 are reasonable for this parameter. Enabling this feature will have the aligner tolerate missing bases in DNA sequences and is most recommended for long, error-prone sequences like MinION reads. In the pairwise output format, frameshifts will be indicated by \ and / for a shift by +1 and -1 nucleotide in the direction of translation respectively." />
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120 </when>
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121 <when value="no"/>
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122 </conditional>
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123 </when>
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124 <when value="blastp">
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125 </when>
3
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126 </conditional>
1
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127 <param argument="--query" type="data" format="fasta,fastq" label="Input query file in FASTA or FASTQ format" />
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128 <conditional name="ref_db_source">
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129 <param name="db_source" type="select" label="Will you select a reference database from your history or use a built-in index?" help="Built-ins were indexed using default options">
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130 <option value="indexed">Use a built-in index</option>
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131 <option value="history">Use one from the history</option>
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132 </param>
6
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133 <when value="indexed">
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134 <param name="index" type="select" label="Select a reference database" help="If your database of interest is not listed, contact your Galaxy admin">
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135 <options from_data_table="diamond_database">
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136 <filter type="sort_by" column="2"/>
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137 <validator type="no_options" message="No indexes are available for the selected input dataset"/>
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138 </options>
1
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139 </param>
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140 </when>
6
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141 <when value="history">
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142 <param name="reference_database" type="data" format="dmnd" label="Select the reference database" />
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143 </when>
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144 </conditional>
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145 <expand macro="output_type_macro" />
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146 <param name="no_self_hits" argument="--no-self-hits" type="boolean" truevalue="--no-self-hits" falsevalue="" checked="true" label="suppress reporting of identical self hits?" help=""/>
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147 <param name='sensitivity' type="select" label="Sensitivity Mode" help="Choose one of the sensitivity modes. The default mode is mainly designed for short read alignment, i.e. finding significant matches of >50 bits on 30-40aa fragments. The sensitive mode is a lot more sensitive than the default and generally recommended for aligning longer sequences. The more sensitive mode provides even more sensitivity. More sensitivity may increase computation time.">
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148 <option value="0" selected="True">Default</option>
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149 <option value="1">Sensitive</option>
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150 <option value="2">More Sensitive</option>
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151 </param>
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152 <param argument="--matrix" type="select" label="Scoring matrix" help="In parentheses are the supported values for (gap open)/(gap extend). In brackets are default gap penalties">
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153 <option value="BLOSUM45">BLOSUM45 ((10-13)/3; (12-16)/2; (16-19)/1) [14/2]</option>
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154 <option value="BLOSUM50">BLOSUM50 ((9-13)/3; (12-16)/2; (15-19)/1) [13/2]</option>
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155 <option value="BLOSUM62" selected="True">BLOSUM62 ((6-11)/2; (9-13)/1) [11/1]</option>
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156 <option value="BLOSUM80">BLOSUM80 ((6-9)/2; 13/2; 25/2; (9-11)/1) [10/1]</option>
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157 <option value="BLOSUM90">BLOSUM90 ((6-9)/2; (9-11)/1) [10/1]</option>
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158 <option value="PAM250">PAM250 ((11-15)/3; (13-17)/2; (17-21)/1) [14/2]</option>
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159 <option value="PAM70">PAM70 ((6-8)/2; (9-11)/1) [10/1]</option>
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160 <option value="PAM30">PAM30 ((5-7)/2; (8-10)/1) [9/1]</option>
3
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161 </param>
6
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162 <param argument="--gapopen" type="integer" optional="True" value="" label="Gap open penalty" help="leave empty for default (see scoring matrix)" />
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163 <param argument="--gapextend" type="integer" optional="True" value="" label="Gap extension penalty" help="leave empty for default (see scoring matrix)" />
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164 <param name="comp_based_stats" argument="--comp-based-stats" type="boolean" truevalue="1" falsevalue="0" checked="true" label="enable composition based statistics?" help="Compositionally biased sequences often cause false positive matches, which are effectively filtered by this algorithm in a way similar to the composition based statistics used by BLAST"/>
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165 <param argument="--masking" type="boolean" truevalue="1" falsevalue="0" checked="true" label="enable masking of low complexity regions?" help="Masked residues appear in the output as X"/>
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166 <conditional name="tax_cond">
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167 <param name="tax_select" type="select" label="Restrict search taxonomically?" help="Any taxonomic rank can be used, and only reference sequences matching one of the specified taxon ids will be searched against">
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168 <option value="no" selected="True">No</option>
6
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169 <option value="list">list of taxids entered manually</option>
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170 <option value="file">list of taxids from single column tabular file</option>
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171 </param>
6
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172 <when value="no"/>
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173 <when value="list">
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174 <param name="taxonlist" argument="--taxonlist" type="text" value="" label="comma separated list of taxon ids" help="" />
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175 </when>
6
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176 <when value="file">
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177 <param name="taxonlistfile" argument="--taxonlist" type="data" format="tabular" label="Keep alignments within the given percentage range of the top alignment score for a quer" help="" />
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178 </when>
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179 </conditional>
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180 <conditional name="filter_score">
1
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181 <param name="filter_score_select" type="select" label="Method to filter?" help="(--evalue/--min-score)">
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182 <option value="evalue" selected="True">Maximum e-value to report alignments</option>
1
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183 <option value="min-score">Minimum bit score to report alignments</option>
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184 </param>
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185 <when value="evalue">
1
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186 <param argument="--evalue" type="float" value="0.001" label="Maximum expected value to keep an alignment" />
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187 </when>
1
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188 <when value="min-score">
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189 <param name="min_score" argument="--min-score" type="integer" value="0" label="Minimum bit score to keep an alignment" help="(--min-score)" />
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190 </when>
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191 </conditional>
6
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192 <expand macro="hit_filter_macro" />
1
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193 <param argument="--id" type="integer" value="0" label="Minimum identity percentage to report an alignment" help="" />
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194 <param name="query_cover" argument="--query-cover" type="integer" value="0" label="Minimum query cover percentage to report an alignment" help="" />
6
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195 <param name="subject_cover" argument="--subject-cover" type="integer" value="0" label="Minimum subject cover percentage to report an alignment" help="" />
1
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196 <param name="block_size" argument="--block-size" type="float" value="2" label="Block size in billions of sequence letters to be processed at a time" help="" />
6
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197 <param argument="--unal" type="boolean" truevalue="1" falsevalue="0" checked="false" label="report unaligned queries" help=""/>
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198 </inputs>
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199 <outputs>
6
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200 <expand macro="output_macro" />
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201 <data format="fasta" name="unalqueries" label="${tool.name} on ${on_string} (unaligned queries)">
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202 <filter>unal == "1"</filter>
1
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203 </data>
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204 </outputs>
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205 <tests>
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206 <test>
6
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207 <conditional name="method_cond">
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208 <param name="method_select" value="blastp" />
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209 </conditional>
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210 <param name="query" value="protein.fasta" ftype="fasta"/>
6
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211 <conditional name="ref_db_source">
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212 <param name="db_source" value="history"/>
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213 <param name="reference_database" value="db.dmnd"/>
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214 </conditional>
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215 <conditional name="output">
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216 <param name="outfmt" value="6"/>
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217 <param name="fields" value="qseqid,sseqid,pident,length,mismatch,gapopen,qstart,qend,sstart,send,evalue,bitscore"/>
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218 </conditional>
3
830516f9521b planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/diamond commit 0a893f1ee7f73d24004a43ec1ba6a4cc03fbfab0
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parents: 1
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219 <param name="sensitivity" value="0"/>
1
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220 <param name="matrix" value="BLOSUM62"/>
6
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221 <param name="comp-based-stat" value="1"/>
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222 <param name="masking" value="1"/>
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223 <conditional name="hit_filter">
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224 <param name="hit_filter_select" value="max"/>
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225 <param name="max_target_seqs" value="25" />
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226 </conditional>
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227 <conditional name="filter_score">
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228 <param name="filter_score_select" value="evalue"/>
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229 <param name="evalue" value="0.001" />
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230 </conditional>
1
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231 <param name="id" value="0"/>
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232 <param name="query_cover" value="0"/>
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233 <param name="block_size" value="2"/>
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234 <output name="blast_tabular" file="diamond_results.tabular"/>
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235 </test>
6
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236 <test>
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237 <conditional name="method_cond">
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238 <param name="method_select" value="blastp" />
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239 </conditional>
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240 <param name="query" value="protein.fasta" ftype="fasta"/>
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241 <conditional name="ref_db_source">
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242 <param name="db_source" value="history"/>
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243 <param name="reference_database" value="db-wtax.dmnd"/>
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244 </conditional>
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245 <conditional name="tax_cond">
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246 <param name="tax_select" value="list"/>
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247 <param name="taxonlist" value="2" />
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248 </conditional>
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249 <conditional name="output">
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250 <param name="outfmt" value="6"/>
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251 <param name="fields" value="qseqid,sseqid,pident,length,mismatch,gapopen,qstart,qend,sstart,send,evalue,bitscore"/>
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252 </conditional>
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253 <param name="sensitivity" value="0"/>
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254 <param name="matrix" value="BLOSUM62"/>
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255 <param name="comp-based-stat" value="1"/>
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256 <param name="masking" value="1"/>
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257 <conditional name="hit_filter">
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258 <param name="hit_filter_select" value="max"/>
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259 <param name="max_target_seqs" value="25" />
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260 </conditional>
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261 <conditional name="filter_score">
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262 <param name="filter_score_select" value="evalue"/>
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263 <param name="evalue" value="0.001" />
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264 </conditional>
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265 <param name="id" value="0"/>
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266 <param name="query_cover" value="0"/>
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267 <param name="block_size" value="2"/>
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268 <output name="blast_tabular" file="diamond_results.wtax.tabular"/>
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269 </test>
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270 <test>
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271 <conditional name="method_cond">
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272 <param name="method_select" value="blastx" />
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273 <conditional name="frameshift_cond">
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274 <param name="frameshift_select" value="yes"/>
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275 </conditional>
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276 </conditional>
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277 <param name="query" value="nucleotide.fasta" ftype="fasta"/>
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278 <conditional name="ref_db_source">
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279 <param name="db_source" value="history"/>
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280 <param name="reference_database" value="db.dmnd"/>
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281 </conditional>
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282 <conditional name="output">
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283 <param name="outfmt" value="0"/>
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284 </conditional>
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285 <param name="sensitivity" value="0"/>
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286 <param name="matrix" value="BLOSUM62"/>
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287 <param name="comp-based-stat" value="1"/>
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288 <param name="masking" value="1"/>
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289 <conditional name="hit_filter">
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290 <param name="hit_filter_select" value="top"/>
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291 <param name="top" value="10" />
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292 </conditional>
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293 <conditional name="filter_score">
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294 <param name="filter_score_select" value="score"/>
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295 <param name="evalue" value="1" />
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296 </conditional>
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297 <param name="id" value="0"/>
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298 <param name="query_cover" value="0"/>
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299 <param name="block_size" value="2"/>
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300 <output name="blast_tabular" file="diamond_results.pairwise"/>
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301 </test>
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302 <test>
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303 <conditional name="method_cond">
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304 <param name="method_select" value="blastp" />
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305 </conditional>
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306 <param name="query" value="protein.fasta" ftype="fasta"/>
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307 <conditional name="ref_db_source">
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308 <param name="db_source" value="history"/>
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309 <param name="reference_database" value="db-wtax.dmnd"/>
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310 </conditional>
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311 <conditional name="output">
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312 <param name="outfmt" value="100"/>
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313 </conditional>
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314 <output name="daa_output" file="diamond_results.daa" compare="sim_size" delta="10"/>
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315 </test>
0
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316 </tests>
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317 <help>
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318 <![CDATA[
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319
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320 **What it does**
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321
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322 DIAMOND_ is a new alignment tool for aligning short DNA sequencing reads to a protein reference database such as NCBI-NR.
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323 On Illumina reads of length 100-150bp, in fast mode, DIAMOND is about 20,000 times faster than BLASTX, while reporting
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324 about 80-90% of all matches that BLASTX finds, with an e-value of at most 1e-5. In sensitive mode, DIAMOND ist about 2,500
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325 times faster than BLASTX, finding more than 94% of all matches.
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326
3
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327 The DIAMOND algorithm is designed for the alignment of large datasets. The algorithm is not efficient for a small number of query sequences or only a single one of them, and speed will be low. BLAST is recommended for small datasets.
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328
0
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329 .. _DIAMOND: http://ab.inf.uni-tuebingen.de/software/diamond/
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330
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331 **Input**
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332
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333 Input data is a large protein or nucleotide sequence file.
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334
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335
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336 **Output**
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337
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338 Diamond gives you a tabular output file with 12 columns:
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339
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340 Column Description
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341 1 Query Seq-id (ID of your sequence)
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342 2 Subject Seq-id (ID of the database hit)
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343 3 Percentage of identical matches
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344 4 Alignment length
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345 5 Number of mismatches
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346 6 Number of gap openings
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347 7 Start of alignment in query
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348 8 End of alignment in query
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349 9 Start of alignment in subject (database hit)
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350 10 End of alignment in subject (database hit)
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351 11 Expectation value (E-value)
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352 12 Bit score
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353
0
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354
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355 Supported values for gap open and gap extend parameters depending on the selected scoring matrix.
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356
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357 ======== ============================================
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358 Matrix Supported values for (gap open)/(gap extend)
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359 ======== ============================================
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360 BLOSUM45 (10-13)/3; (12-16)/2; (16-19)/1
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361 BLOSUM50 (9-13)/3; (12-16)/2; (15-19)/1
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362 BLOSUM62 (6-11)/2; (9-13)/1
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363 BLOSUM80 (6-9)/2; 13/2; 25/2; (9-11)/1
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364 BLOSUM90 (6-9)/2; (9-11)/1
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365 PAM250 (11-15)/3; (13-17)/2; (17-21)/1
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366 PAM70 (6-8)/2; (9-11)/1
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367 PAM30 (5-7)/2; (8-10)/1
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368 ======== ============================================
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369
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370
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371 ]]>
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372 </help>
1
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373 <expand macro="citations" />
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374 </tool>