Mercurial > repos > bioinformatics_lab_ufsc > epibuilder
annotate epibuilder-1.1.xml @ 2:8fa9e663cca5 draft
Uploaded corrected condition for use_hit
author | bioinformatics_lab_ufsc |
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date | Thu, 25 Nov 2021 03:59:45 +0000 |
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1 <tool id="epibuilder_1.1" name="EpiBuilder" version="1.1"> |
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2 <description>Predict B cell epitopes</description> |
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3 <requirements> |
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4 <requirement type="package" version=">=1.8">Java</requirement> |
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5 <requirement type="package" version=">=2.11.0+">Blastp</requirement> |
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6 <requirement type="package" version=">=2.11.0+">Makeblastdb</requirement> |
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7 </requirements> |
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8 <stdio> |
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9 <regex match="command not found" |
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10 source="both" |
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11 level="log" |
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12 description="WARNING: some methods could not be applied -> check inputs and outputs files" /> |
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13 <regex match="makeblastdb " |
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14 source="both" |
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15 level="log" |
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16 description="makeblastdb and blastp must be in $PATH on your Galaxy server" /> |
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17 <regex match="blastp " |
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18 source="both" |
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19 level="log" |
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20 description="makeblastdb and blastp must be in $PATH on your Galaxy server" /> |
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21 </stdio> |
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22 <command><![CDATA[ |
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23 #*<!-- |
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24 Methods used will be saved in $param with each threshold |
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25 Threshold is separated from method by ":" |
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26 Each method is separated by ";" |
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27 example: emini:0.8;parker:d; |
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28 |
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29 >> d means defalt threshold |
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30 -->*# |
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31 |
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32 #*<!-- Set variables that concatenate methods -->*# |
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33 #set param = '' |
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34 #set nomethod = '' |
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35 #set proteomes = '' |
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36 |
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37 #*<!-- Add Bepipred2.0 method -->*# |
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38 #if $bepi_type.bepipred_origin == 'y': |
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39 #set bepipred_origin = '-o' |
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40 #*<!-- jobid -->*# |
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41 #elif $bepi_type.bepipred_origin == 'id': |
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42 #set bepipred_origin = '-jobid ' + str($bepi_type.job_id) |
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43 #else: |
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44 #set bepipred_origin = '' |
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45 #end if |
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46 |
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47 #*<!-- Add Emini method -->*# |
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48 #if $emini_method.emini_choice == 'eminiyes': |
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49 #if $emini_method.emini_t.t_emini == 't_emini_choice' |
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50 #set param += 'emini:' + str($emini_method.emini_t.thresh_em_value) + ';' |
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51 #else: |
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52 #set param += 'emini:d;' |
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53 #end if |
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54 #end if |
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55 |
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56 #*<!-- Add Parker method -->*# |
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57 #if $parker_method.parker_choice == 'parkeryes': |
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58 #if $parker_method.parker_t.t_parker == 't_parker_choice' |
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59 #set param += 'parker:' + str($parker_method.parker_t.thresh_park_value) + ';' |
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60 #else: |
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61 #set param += 'parker:d;' |
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62 #end if |
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63 #end if |
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64 |
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65 #*<!-- Add Chou method -->*# |
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66 #if $chou_method.chou_choice == 'chouyes': |
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67 #if $chou_method.chou_t.t_chou == 't_chou_choice' |
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68 #set param += 'chou_fosman:' + str($chou_method.chou_t.thresh_chou_value) + ';' |
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69 #else: |
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70 #set param += 'chou_fosman:d;' |
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71 #end if |
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72 #end if |
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73 |
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74 #*<!-- Add Karplus method -->*# |
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75 #if $karplus_method.karplus_choice == 'karplusyes': |
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76 #if $karplus_method.karplus_t.t_karplus == 't_karplus_choice' |
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77 #set param += 'karplus_schulz:' + str($karplus_method.karplus_t.thresh_karplus_value) + ';' |
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78 #else: |
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79 #set param += 'karplus_schulz:d;' |
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80 #end if |
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81 #end if |
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82 |
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83 #*<!-- Add Kolaskar method -->*# |
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84 #if $kolaskar_method.kolaskar_choice == 'kolaskaryes': |
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85 #if $kolaskar_method.kolaskar_t.t_kolaskar == 't_kolaskar_choice' |
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86 #set param += 'kolaskar:' + str($kolaskar_method.kolaskar_t.thresh_kolaskar_value) + ';' |
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87 #else: |
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88 #set param += 'kolaskar:d;' |
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89 #end if |
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90 #end if |
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91 |
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92 |
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93 |
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94 #*<!-- Clean $proteome if there's no protome -->*# |
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95 #if proteomes == '-proteomes ': |
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96 #set proteomes = '' |
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97 #end if |
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98 |
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99 |
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100 #*<!-- Parse blast command -->*# |
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101 |
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102 #if $use_search.search_use_bool == "use": |
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103 #*<!-- Add proteomes, as many as given -->*# |
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104 #if $use_search.prot_input: |
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105 #for $file in $use_search.prot_input: |
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106 #set proteomes += str($file.prot_name) + '=' + str($file.prot_file) + ';' |
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107 #end for |
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108 #end if |
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109 #if $use_search.prot_input: |
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110 #if $use_search.blast.blast_search == 'blastyes': |
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111 #set blast_command = 'task=' + str($use_search.blast.blast_task) |
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112 #set blast_command += ';identity=' + str($use_search.blast.blast_id) + ';cover=' + str($use_search.blast.blast_cover) + ';word-size=' + str($use_search.blast.blast_wordsize) |
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113 #set blast_command += ';makeblastdb_path=makeblastdb;blastp_path=blastp' |
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114 #end if |
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115 #end if |
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116 #end if |
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117 |
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118 #*<!-- Paste Command-line and run -->*# |
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119 |
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120 java -jar $__tool_directory__/epibuilder-1.1.jar |
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121 |
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122 #*<!-- bepipred_origin give -o if online, nothing if command and -jobid if jobID -->*# |
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123 #*<!-- if origin is not jobid, there is a file, and -b must be passed -->*# |
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124 #if $bepi_type.bepipred_origin != 'id': |
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125 -b ${bepi_type.bepi_out} |
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126 #end if |
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127 -t ${tresh_bepi2} |
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128 ${bepipred_origin} |
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129 #if $param: |
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130 -p "${param}" |
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131 #end if |
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132 -f "${basename}" |
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133 -min_len ${min_length} |
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134 -max_len ${max_length} |
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135 #if $proteomes: |
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136 -proteomes |
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137 "${proteomes}" |
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138 #if $use_search.blast.blast_search == 'blastyes': |
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139 -blast "${blast_command}" |
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140 #end if |
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141 #end if |
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142 |
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143 #if $use_search.check_use_hit == 'nousehit': |
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144 -nohitacc |
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145 #end if |
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146 #*<!-- DONT REMOVE THIS ; -->*# |
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147 >log.log 2>log.log; |
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148 |
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149 mv $basename-epibuilder.xlsx EpiBuilder_report.xlsx; |
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150 |
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151 #*<!-- Rename output files -->*# |
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152 mv ${basename}-epibuilder.txt EpiBuilder; |
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153 |
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154 |
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155 ]]> |
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156 </command> |
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157 <inputs> |
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158 <!-- Bepipred 2.0 --> |
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159 <conditional name="bepi_type"> |
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160 <param name="bepipred_origin" type="select" display="radio" label="Input files" help="Online prediction returns a csv file, command-line based returns a tsv file" > |
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161 <option value="y" selected="true">csv file from Bepipred 2.0</option> |
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162 <option value="n" >text file from IEDB Bcell Software standalone</option> |
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163 <option value="id">JobID from Bepipred 2.0 Server</option> |
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164 </param> |
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165 <when value="y" > |
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166 <param name="bepi_out" multiple="false" format="data" type="data" label="File" help="Epitopes predicted by Bepipred 2.0" /> |
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167 </when> |
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168 <when value="n" > |
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169 <param name="bepi_out" multiple="false" format="data" type="data" label="File" help="Epitopes predicted by Bepipred 2.0" /> |
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170 </when> |
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171 <when value="id" > |
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172 <param name="job_id" type="text" value="" label="JobID" help="Prediction must be complete - check it in: http://www.cbs.dtu.dk/cgi-bin/webface2.fcgi?jobid=YOUR_JOB_ID" > |
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173 <!-- Check if its an empty value--> |
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174 <validator type="empty_field" message="ID required"/> |
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175 </param> |
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176 </when> |
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177 </conditional> |
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178 <param name="tresh_bepi2" min="0.0" value="0.6" type="float" label="Threshold for Bepipred 2.0" help="Default = 0.6" /> |
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179 <!-- Epitope Length --> |
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180 <param name="min_length" value="10" min="1" type="integer" label="Min epitope length" help="[1-X] Minimal length must be smaller than maximal length" /> |
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181 <param name="max_length" value="30" min="2" type="integer" label="Max epitope length" help="[2-X] Maximal length must be greather than minimal length" /> |
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182 <!-- EMINI --> |
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183 <conditional name="emini_method"> |
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184 <param name="emini_choice" type="boolean" checked="true" truevalue="eminiyes" falsevalue="eminino" label="Use Emini Surface Accessibility Prediction method?" /> |
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185 <when value="eminino"> |
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186 </when> |
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187 <when value="eminiyes"> |
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188 <conditional name="emini_t"> |
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189 <param name="t_emini" display="radio" type="select" label="Threshold" help="Define threshold for Emini" > |
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190 <option value="d_emini_choice" selected="true">Default (calculated by method)</option> |
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191 <option value="t_emini_choice">Set Threshold</option> |
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192 </param> |
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193 <when value="t_emini_choice"> |
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194 <param name="thresh_em_value" value="0" type="float" label="Value" /> |
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195 </when> |
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196 <when value="d_emini_choice"> |
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197 </when> |
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198 </conditional> |
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199 </when> |
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200 </conditional> |
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201 <!-- PARKER --> |
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202 <conditional name="parker_method"> |
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203 <param name="parker_choice" type="boolean" checked="true" truevalue="parkeryes" falsevalue="parkerno" label="Use Parker Hydrophilicity Prediction method?" /> |
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204 <when value="parkerno"> |
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205 </when> |
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206 <when value="parkeryes"> |
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207 <conditional name="parker_t"> |
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208 <param name="t_parker" display="radio" type="select" label="Threshold" help="Define threshold for Parker" > |
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209 <option value="d_parker_choice" selected="true">Default (calculated by method)</option> |
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210 <option value="t_parker_choice">Set Threshold</option> |
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211 </param> |
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212 <when value="t_parker_choice"> |
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213 <param name="thresh_park_value" value="0" type="float" label="Value" /> |
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214 </when> |
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215 <when value="d_parker_choice"> |
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216 </when> |
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217 </conditional> |
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218 </when> |
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219 </conditional> |
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220 <!-- Chou --> |
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221 <conditional name="chou_method"> |
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222 <param name="chou_choice" type="boolean" checked="true" truevalue="chouyes" falsevalue="chouno" label="Use Chou & Fasman Beta-Turn Prediction method?" /> |
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223 <when value="chouno"> |
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224 </when> |
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225 <when value="chouyes"> |
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226 <conditional name="chou_t"> |
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227 <param name="t_chou" display="radio" type="select" label="Threshold" help="Define threshold for Chou & Fasman" > |
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228 <option value="d_chou_choice" selected="true">Default (calculated by method)</option> |
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229 <option value="t_chou_choice">Set Threshold</option> |
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230 </param> |
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231 <when value="t_chou_choice"> |
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232 <param name="thresh_chou_value" value="0" type="float" label="Value" /> |
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233 </when> |
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234 <when value="d_chou_choice"> |
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235 </when> |
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236 </conditional> |
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237 </when> |
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238 </conditional> |
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239 <!-- Karplus --> |
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240 <conditional name="karplus_method"> |
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241 <param name="karplus_choice" type="boolean" checked="true" truevalue="karplusyes" falsevalue="karplusno" label="Use Karplus & Schulz Flexibility Prediction method?" /> |
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242 <when value="karplusno"> |
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243 </when> |
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244 <when value="karplusyes"> |
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245 <conditional name="karplus_t"> |
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246 <param name="t_karplus" display="radio" type="select" label="Threshold" help="Define threshold for Karplus & Schulz" > |
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247 <option value="d_karplus_choice" selected="true">Default (calculated by method)</option> |
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248 <option value="t_karplus_choice">Set Threshold</option> |
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249 </param> |
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250 <when value="t_karplus_choice"> |
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251 <param name="thresh_karplus_value" type="float" value="0" label="Value" /> |
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252 </when> |
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253 <when value="d_karplus_choice"> |
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254 </when> |
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255 </conditional> |
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256 </when> |
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257 </conditional> |
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258 <!-- Kolaskar --> |
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259 <conditional name="kolaskar_method"> |
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260 <param name="kolaskar_choice" type="boolean" checked="true" truevalue="kolaskaryes" falsevalue="kolaskarno" label="Use Kolaskar & Tongaonkar Antigenicity method?" /> |
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261 <when value="kolaskarno"> |
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262 </when> |
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263 <when value="kolaskaryes"> |
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264 <conditional name="kolaskar_t"> |
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265 <param name="t_kolaskar" display="radio" type="select" label="Threshold" help="Define threshold for Kolaskar & Tongaonkar" > |
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266 <option value="d_kolaskar_choice" selected="true">Default (calculated by method)</option> |
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267 <option value="t_kolaskar_choice">Set Threshold</option> |
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268 </param> |
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269 <when value="t_kolaskar_choice"> |
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270 <param name="thresh_kolaskar_value" type="float" value="0" label="Value" /> |
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271 </when> |
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272 <when value="d_kolaskar_choice"> |
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273 </when> |
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274 </conditional> |
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275 </when> |
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276 </conditional> |
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277 <!-- Insert Proteome --> |
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278 <conditional name="use_search"> |
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279 <param name="search_use_bool" type="boolean" checked="false" truevalue="use" falsevalue="dont" label="Do you want to search the predicted epitopes in a proteome file?" /> |
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280 <when value="dont"> |
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281 </when> |
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282 <when value="use"> |
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283 <repeat name="prot_input" title="Proteome" min="1"> |
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changeset
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284 <param type="data" name="prot_file" format="fasta" label="Proteome file" help="Protein sequences in fasta format" /> |
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285 <param type="text" name="prot_name" label="Proteome name" help="Give a name to this dataset" > |
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286 <!-- Change spaces for '_' --> |
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287 <sanitizer> |
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parents:
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288 <valid initial="string.printable"> |
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parents:
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289 <remove value=" "/> |
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parents:
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290 </valid> |
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parents:
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changeset
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291 <mapping initial="none"> |
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parents:
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changeset
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292 <add source=" " target="_"/> |
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293 </mapping> |
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294 </sanitizer> |
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parents:
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changeset
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295 <!-- Check if its an empty value--> |
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296 <validator type="empty_field" message="Basename required"/> |
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297 </param> |
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298 </repeat> |
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299 <param name="check_use_hit" type="boolean" checked="true" truevalue="usehit" falsevalue="nousehit" label="Show accession ID on result files?" help="Choose this option if you want to add accession ID numbers" /> |
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Uploaded corrected condition for use_hit
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changeset
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300 <conditional name="blast"> |
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changeset
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301 <param name="blast_search" type="boolean" checked="false" truevalue="blastyes" falsevalue="blastno" label="Blastp" help="Choose this option if you want to add a blast search for epitopes in proteomes" /> |
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Uploaded corrected condition for use_hit
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changeset
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302 <when value="blastno"> |
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bioinformatics_lab_ufsc
parents:
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changeset
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303 </when> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
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304 <when value="blastyes"> |
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bioinformatics_lab_ufsc
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changeset
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305 <param name="blast_id" value="90" min="1" type="integer" label="Identity" help="[0-100] Minimal identity accepted to parse blast results" /> |
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changeset
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306 <param name="blast_cover" value="90" min="2" type="integer" label="Coverage" help="[0-100] Minimal coverage accepted to parse blast results" /> |
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changeset
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307 <param name="blast_wordsize" value="4" min="1" type="integer" label="Word-Size" help="Blast argument word-size" /> |
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changeset
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308 <param name="blast_task" type="select" label="Task" help="How blastp should run"> |
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309 <option value="blastp-short" selected="True">Blastp-short</option> |
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310 <option value="blastp-fast">Blastp-fast</option> |
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bioinformatics_lab_ufsc
parents:
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changeset
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311 <option value="blastp">Blastp</option> |
8fa9e663cca5
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bioinformatics_lab_ufsc
parents:
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changeset
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312 </param> |
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bioinformatics_lab_ufsc
parents:
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changeset
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313 </when> |
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bioinformatics_lab_ufsc
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changeset
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314 </conditional> |
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bioinformatics_lab_ufsc
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changeset
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315 </when> |
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316 </conditional> |
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changeset
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317 <param name="basename" type="text" value="" label="Basename" help="Provide a name for this run (string text without special characters)" > |
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changeset
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318 <!-- Change spaces for '_' --> |
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parents:
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changeset
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319 <sanitizer> |
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parents:
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changeset
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320 <valid initial="string.printable"> |
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parents:
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changeset
|
321 <remove value=" "/> |
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bioinformatics_lab_ufsc
parents:
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changeset
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322 </valid> |
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bioinformatics_lab_ufsc
parents:
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changeset
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323 <mapping initial="none"> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
324 <add source=" " target="_"/> |
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bioinformatics_lab_ufsc
parents:
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changeset
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325 </mapping> |
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parents:
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changeset
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326 </sanitizer> |
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bioinformatics_lab_ufsc
parents:
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changeset
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327 <!-- Check if its an empty value--> |
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bioinformatics_lab_ufsc
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changeset
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328 <validator type="empty_field" message="Basename required"/> |
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bioinformatics_lab_ufsc
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329 </param> |
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bioinformatics_lab_ufsc
parents:
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changeset
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330 </inputs> |
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bioinformatics_lab_ufsc
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changeset
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331 <outputs> |
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changeset
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332 <data name="epif_out" format="txt" from_work_dir="EpiBuilder" label="EpiBuilder Output Summary - ${basename}" /> |
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333 <data name="ep_xls" format="xlsx" from_work_dir="EpiBuilder_report.xlsx" label="EpiBuilder Report - ${basename}" /> |
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334 <collection type="list" label="EpiBuilder Files - ${basename}" name="epif_collection" > |
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changeset
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335 <discover_datasets format="fasta" pattern="(?P<designation>.*)\.fasta" visible="false" /> |
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changeset
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336 <discover_datasets format="txt" pattern="(?P<designation>.*)\.tsv" visible="false" /> |
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changeset
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337 <discover_datasets format="txt" pattern="(?P<designation>.*)\.txt" visible="false" /> |
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Uploaded corrected condition for use_hit
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338 </collection> |
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bioinformatics_lab_ufsc
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changeset
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339 <collection type="list" label="EpiBuilder Blast Run - ${basename}" name="blast_collection" > |
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Uploaded corrected condition for use_hit
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changeset
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340 <filter>use_search['search_use_bool'] is True and use_search['blast']['blast_search'] is True</filter> |
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bioinformatics_lab_ufsc
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341 <discover_datasets pattern="(?P<designation>.*)blast\.csv" visible="false" /> |
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342 </collection> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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343 </outputs> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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changeset
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344 <tests> |
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bioinformatics_lab_ufsc
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changeset
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345 <test> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
346 <!-- Test all methods threshold selected, command line version of input with proteome--> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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changeset
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347 <conditional name="bepi_type"> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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348 <param name="bepipred_origin" value="y"/> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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changeset
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349 <param name="bepi_out" value="input_bepi_online.csv"/> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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350 </conditional> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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changeset
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351 <param name="tresh_bepi2" value="0.6"/> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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changeset
|
352 |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
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353 <param name="min_length" value="10" /> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
354 <param name="max_length" value="30" /> |
8fa9e663cca5
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bioinformatics_lab_ufsc
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changeset
|
355 |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
356 <conditional name="emini_method"> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
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357 <param name="emini_choice" value="eminiyes"/> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
358 <conditional name="emini_t"> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
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359 <param name="t_emini" value="t_emini_choice"/> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
360 <param name="thresh_em_value" value="0.8" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
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361 </conditional> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
362 </conditional> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
363 |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
364 <conditional name="parker_method"> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
365 <param name="parker_choice" value="parkeryes"/> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
366 <conditional name="parker_t"> |
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bioinformatics_lab_ufsc
parents:
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changeset
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367 <param name="t_parker" value="t_parker_choice"/> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
368 <param name="thresh_park_value" value="0.8" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
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369 </conditional> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
370 </conditional> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
371 |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
372 <conditional name="chou_method"> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
373 <param name="chou_choice" value="chouyes"/> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
374 <conditional name="chou_t"> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
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375 <param name="t_chou" value="t_chou_choice"/> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
376 <param name="thresh_chou_value" value="0.8" /> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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changeset
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377 </conditional> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
378 </conditional> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
379 |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
380 <conditional name="karplus_method"> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
381 <param name="karplus_choice" value="karplusyes"/> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
382 <conditional name="karplus_t"> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
383 <param name="t_karplus" value="t_karplus_choice"/> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
384 <param name="thresh_karplus_value" value="0.8" /> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
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385 </conditional> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
386 </conditional> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
387 |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
388 |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
389 <conditional name="kolaskar_method"> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
390 <param name="kolaskar_choice" value="kolaskaryes"/> |
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bioinformatics_lab_ufsc
parents:
diff
changeset
|
391 <conditional name="kolaskar_t"> |
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bioinformatics_lab_ufsc
parents:
diff
changeset
|
392 <param name="t_kolaskar" value="t_kolaskar_choice"/> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
393 <param name="thresh_kolaskar_value" value="0.8" /> |
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394 </conditional> |
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bioinformatics_lab_ufsc
parents:
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395 </conditional> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
396 <!-- This first part test all methods--> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
397 |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
398 <conditional name="use_search"> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
399 <param name="search_use_bool" value="use" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
400 <repeat name="prot_input"> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
401 <param name="prot_name" value="test_proteom" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
402 <param name="prot_file" value="proteom.fasta" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
403 </repeat> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
404 <param name="check_use_hit" value="usehit"/> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
405 <conditional name="blast"> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
406 <param name="blast_search" value="blastyes" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
407 <param name="blast_id" value="90" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
408 <param name="blast_cover" value="90" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
409 <param name="blast_wordsize" value="4" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
410 <param name="blast_task" value="blastp-short" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
411 </conditional> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
412 </conditional> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
413 |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
414 <param name="basename" value="online" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
415 |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
416 <output name="epif_out" file="online-EpiBuilder.txt" /> |
8fa9e663cca5
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bioinformatics_lab_ufsc
parents:
diff
changeset
|
417 <output name="ep_xls" file="online-EpiBuilder.xlsx" /> |
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bioinformatics_lab_ufsc
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changeset
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418 <output_collection name= "epif_collection"> |
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bioinformatics_lab_ufsc
parents:
diff
changeset
|
419 <element name="ep_prot_sum" file="online-EpiBuilder-protein-summary.tsv" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
420 <element name="ep_top" file="online-EpiBuilder-topology.tsv" /> |
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bioinformatics_lab_ufsc
parents:
diff
changeset
|
421 <element name="ep_score" file="online-EpiBuilder-socre.tsv" /> |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
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422 <element name="ep_detail" file="online-EpiBuilder-epitope-detail.tsv" /> |
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423 <element name="ep_parameters" file="online-EpiBuilder-parameters.tsv" /> |
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424 <element name="ep_fasta" file="online-EpiBuilder-fasta.fasta" /> |
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425 </output_collection> |
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426 <output_collection name="blast_collection" > |
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parents:
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changeset
|
427 <element name="test_proteom" file="online-test_proteom_blast.csv" ftype="csv" /> |
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428 </output_collection > |
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429 </test> |
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changeset
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430 |
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bioinformatics_lab_ufsc
parents:
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changeset
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431 <test> |
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parents:
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432 <!-- Test all methods threshold selected, online version of input with proteome--> |
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bioinformatics_lab_ufsc
parents:
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433 <conditional name="bepi_type"> |
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parents:
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434 <param name="bepipred_origin" value="y"/> |
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parents:
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changeset
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435 <param name="bepi_out" value="input_bcell_command_line.txt"/> |
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436 </conditional> |
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437 |
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parents:
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438 <param name="bepipred_origin" value="n"/> |
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bioinformatics_lab_ufsc
parents:
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439 <param name="tresh_bepi2" value="0.6"/> |
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440 |
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parents:
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441 <param name="min_length" value="10" /> |
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parents:
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442 <param name="max_length" value="30" /> |
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443 |
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parents:
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444 <conditional name="emini_method"> |
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parents:
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445 <param name="emini_choice" value="eminiyes"/> |
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bioinformatics_lab_ufsc
parents:
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changeset
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446 <conditional name="emini_t"> |
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parents:
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447 <param name="t_emini" value="t_emini_choice"/> |
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bioinformatics_lab_ufsc
parents:
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448 <param name="thresh_em_value" value="0.8" /> |
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parents:
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449 </conditional> |
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450 </conditional> |
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parents:
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451 |
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bioinformatics_lab_ufsc
parents:
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changeset
|
452 <conditional name="parker_method"> |
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parents:
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453 <param name="parker_choice" value="parkeryes"/> |
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parents:
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changeset
|
454 <conditional name="parker_t"> |
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parents:
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455 <param name="t_parker" value="t_parker_choice"/> |
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bioinformatics_lab_ufsc
parents:
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456 <param name="thresh_park_value" value="0.8" /> |
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bioinformatics_lab_ufsc
parents:
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457 </conditional> |
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parents:
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458 </conditional> |
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parents:
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changeset
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459 |
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bioinformatics_lab_ufsc
parents:
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changeset
|
460 <conditional name="chou_method"> |
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bioinformatics_lab_ufsc
parents:
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461 <param name="chou_choice" value="chouyes"/> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
462 <conditional name="chou_t"> |
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bioinformatics_lab_ufsc
parents:
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463 <param name="t_chou" value="t_chou_choice"/> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
464 <param name="thresh_chou_value" value="0.8" /> |
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465 </conditional> |
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466 </conditional> |
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467 |
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bioinformatics_lab_ufsc
parents:
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changeset
|
468 <conditional name="karplus_method"> |
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bioinformatics_lab_ufsc
parents:
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469 <param name="karplus_choice" value="karplusyes"/> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
470 <conditional name="karplus_t"> |
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bioinformatics_lab_ufsc
parents:
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471 <param name="t_karplus" value="t_karplus_choice"/> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
472 <param name="thresh_karplus_value" value="0.8" /> |
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bioinformatics_lab_ufsc
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473 </conditional> |
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bioinformatics_lab_ufsc
parents:
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474 </conditional> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
475 |
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bioinformatics_lab_ufsc
parents:
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changeset
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476 |
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bioinformatics_lab_ufsc
parents:
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changeset
|
477 <conditional name="kolaskar_method"> |
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bioinformatics_lab_ufsc
parents:
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changeset
|
478 <param name="kolaskar_choice" value="kolaskaryes"/> |
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479 <conditional name="kolaskar_t"> |
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parents:
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480 <param name="t_kolaskar" value="t_kolaskar_choice"/> |
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481 <param name="thresh_kolaskar_value" value="0.8" /> |
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482 </conditional> |
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483 </conditional> |
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bioinformatics_lab_ufsc
parents:
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|
484 <!-- This first part test all methods--> |
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bioinformatics_lab_ufsc
parents:
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|
485 |
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bioinformatics_lab_ufsc
parents:
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486 <conditional name="use_search"> |
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parents:
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487 <param name="search_use_bool" value="use"/> |
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parents:
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488 <repeat name="prot_input"> |
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parents:
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489 <param name="prot_name" value="test_proteom" /> |
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bioinformatics_lab_ufsc
parents:
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490 <param name="prot_file" value="proteom.fasta" /> |
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parents:
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491 </repeat> |
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parents:
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492 <param name="check_use_hit" value="usehit"/> |
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bioinformatics_lab_ufsc
parents:
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493 <conditional name="blast"> |
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494 <param name="blast_search" value="blastyes" /> |
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bioinformatics_lab_ufsc
parents:
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495 <param name="blast_id" value="90" /> |
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496 <param name="blast_cover" value="90"/> |
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497 <param name="blast_wordsize" value="4" /> |
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parents:
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498 <param name="blast_task" value="blastp-short" /> |
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parents:
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499 </conditional> |
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parents:
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500 </conditional> |
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parents:
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501 |
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parents:
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502 <param name="basename" value="command" /> |
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503 |
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parents:
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504 <output name="epif_out" file="command-EpiBuilder.txt" /> |
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505 <output name="ep_xls" file="command-EpiBuilder.xlsx" /> |
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506 <output_collection name= "epif_collection"> |
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507 <element name="ep_prot_sum" file="command-EpiBuilder-protein-summary.tsv" /> |
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508 <element name="ep_top" file="command-EpiBuilder-topology.tsv" /> |
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509 <element name="ep_score" file="command-EpiBuilder-socre.tsv" /> |
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510 <element name="ep_detail" file="command-EpiBuilder-epitope-detail.tsv" /> |
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511 <element name="ep_parameters" file="command-EpiBuilder-parameters.tsv" /> |
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512 <element name="ep_fasta" file="command-EpiBuilder-fasta.fasta" /> |
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513 </output_collection> |
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parents:
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514 <output_collection name="blast_collection" > |
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|
515 <element name="test_proteom" file="command-test_proteom_blast.csv" ftype="csv" /> |
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516 </output_collection > |
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517 </test> |
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parents:
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518 </tests> |
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parents:
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519 <help> |
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parents:
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|
520 **How to Run** |
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521 |
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parents:
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522 First, you must have a file with epitopes predicted by Bepipred 2.0 or have one job submmited into bepipred's server. |
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523 |
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bioinformatics_lab_ufsc
parents:
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524 .. class:: warningmark |
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parents:
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|
525 |
8fa9e663cca5
Uploaded corrected condition for use_hit
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parents:
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526 Input this file (or jobID) and specify if Bepipred 2.0 was ran online or command-line based through bcell standalone suite. |
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527 |
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parents:
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528 Select methods that you want to check your epitopes for validation. |
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529 |
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bioinformatics_lab_ufsc
parents:
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530 Give a threshold for each method (or use default threshold). |
8fa9e663cca5
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bioinformatics_lab_ufsc
parents:
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changeset
|
531 |
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bioinformatics_lab_ufsc
parents:
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532 Optionaly, you can search validated epitopes in proteomes datasets, as many as you wish. |
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parents:
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changeset
|
533 |
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parents:
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534 .. class:: warningmark |
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parents:
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changeset
|
535 |
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bioinformatics_lab_ufsc
parents:
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536 If you want to search using Blastp, this software and Makeblastdb must be avaliable on your server's $PATH. |
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537 |
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bioinformatics_lab_ufsc
parents:
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|
538 ----- |
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539 |
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parents:
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540 **Outputs** |
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|
541 |
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542 |
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bioinformatics_lab_ufsc
parents:
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543 **Summary** : Prediction overview |
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parents:
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544 |
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parents:
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545 **Protein Summary** : Show proteins that have epitopes predicted |
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|
546 |
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parents:
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547 **Fasta** : Epitopes' sequences |
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parents:
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|
548 |
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bioinformatics_lab_ufsc
parents:
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549 **Topology** : Show epitope match in each method, aminoacid per aminoacid |
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parents:
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changeset
|
550 |
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parents:
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551 **Score** : Detailed score for aminoacids |
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parents:
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|
552 |
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parents:
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553 **Epitope Detail** : Properties of each predicted epitope |
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parents:
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changeset
|
554 |
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parents:
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555 **Parameters** : Softwares, thresholds and parameters used for prediction |
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parents:
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changeset
|
556 |
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bioinformatics_lab_ufsc
parents:
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557 **Xls Report** : Table with epitope detail, protein summary, topology and scores |
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parents:
diff
changeset
|
558 |
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559 **Collection with blast files** : All blast results for each proteome |
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parents:
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changeset
|
560 |
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bioinformatics_lab_ufsc
parents:
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changeset
|
561 |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
562 ----- |
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bioinformatics_lab_ufsc
parents:
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changeset
|
563 |
8fa9e663cca5
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bioinformatics_lab_ufsc
parents:
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|
564 .. class:: infomark |
8fa9e663cca5
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bioinformatics_lab_ufsc
parents:
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changeset
|
565 |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
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566 **For more information, checkout our GitHub page**: https://github.com/bioinfo-ufsc/EpiBuilder |
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bioinformatics_lab_ufsc
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|
567 |
8fa9e663cca5
Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
diff
changeset
|
568 ----- |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
parents:
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changeset
|
569 |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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570 Please cite methods used in your analysis, available bellow |
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bioinformatics_lab_ufsc
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571 |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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572 | Bioinformatics Lab - UFSC - 2021 |
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bioinformatics_lab_ufsc
parents:
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573 |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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574 </help> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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575 <citations> |
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Uploaded corrected condition for use_hit
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576 <citation type="doi">10.1093/nar/gkx346</citation> |
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577 <citation type="doi">10.1016/0014-5793(90)80535-q</citation> |
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578 <citation type="doi">10.1002/9780470122921.ch2</citation> |
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Uploaded corrected condition for use_hit
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579 <citation type="doi">10.1021/bi00367a013</citation> |
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580 <citation type="doi">https://doi.org/10.1007/BF01195768</citation> |
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581 <citation type="doi">doi:10.1128/jvi.55.3.836-839.1985</citation> |
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582 <citation type="doi">10.1371/journal.pcbi.1006791</citation> |
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583 <citation type="doi">https://doi.org/10.1093/nar/gky379</citation> |
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Uploaded corrected condition for use_hit
bioinformatics_lab_ufsc
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584 </citations> |
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Uploaded corrected condition for use_hit
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585 </tool> |