Mercurial > repos > iracooke > mascot
diff mascot.xml @ 5:327b2d99d4c5
Update
author | Ira Cooke <iracooke@gmail.com> |
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date | Sun, 09 Jun 2013 08:17:38 -0500 |
parents | d9564913a944 |
children |
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--- a/mascot.xml Tue Mar 05 00:18:41 2013 -0500 +++ b/mascot.xml Sun Jun 09 08:17:38 2013 -0500 @@ -2,13 +2,28 @@ <requirements> - <requirement type="package" version="1.2.0">galaxy_protk</requirement> + <requirement type="package" version="1.2.2">galaxy_protk</requirement> </requirements> <description>Mascot MS/MS Search</description> - <command>rvm 1.9.3@protk-1.2.0 do mascot_search.rb -d $database -f $fragment_ion_tol -S $server $input_file -o $output -r + <command>rvm 1.9.3@protk-1.2.2 do mascot_search.rb + + #if $database.source_select=="built_in": + -d $database.dbkey + #else + -d $database.custom_db + #end if + + -f $fragment_ion_tol + + -S $server $input_file + + -o $output + + -r + ## Variable Mods --var-mods=' @@ -18,34 +33,61 @@ --fix-mods=' $fixed_mods ' - --allowed-charges=$allowed_charges --enzyme=$enzyme --instrument=$instrument --precursor-ion-tol-units=$precursor_tolu --email=$email --username=$username -v $missed_cleavages - + --allowed-charges=$allowed_charges + + --enzyme=$enzyme + + --instrument=$instrument + + --precursor-ion-tol-units=$precursor_tolu + + --email=$email + + -v $missed_cleavages + + #if $security.security_use + --use-security + --username $security.username + --password $security.password + #end if + + #if $proxy + --proxy $proxy + #end if + </command> <inputs> <param name="input_file" type="data" format="mgf" multiple="false" label="MSMS File" help="A Mascot Generic Format file containing MSMS Spectra"/> - <param name="database" type="select" format="text" > - <label>Database</label> - <options from_file="mascot_databases.loc"> - <column name="name" index="0" /> - <column name="value" index="2" /> - </options> - </param> + <conditional name="database"> + <param name="source_select" type="select" label="Database Type"> + <option value="built_in">Built-In</option> + <option value="custom_defined">Custom</option> + </param> + <when value="built_in"> + <param name="dbkey" type="select" format="text" > + <label>Database</label> + <options from_file="mascot_databases.loc"> + <column name="name" index="0" /> + <column name="value" index="2" /> + </options> + </param> + </when> + <when value="custom_defined"> + <param name="custom_db" type="text" size="80" value="SwissProt" label="Database Name" help="Exact name of a database defined on the Mascot server (case-sensitive)"/> + </when> + </conditional> - - - <param name="variable_mods" format="text" type="select" multiple="true" label="Variable Modifications" help="Hold the appropriate key while - clicking to select multiple items"> + <param name="variable_mods" format="text" type="select" multiple="true" label="Variable Modifications" help="Multiple values allowed"> <options from_file="mascot_mods.loc"> <column name="name" index="0" /> <column name="value" index="2" /> </options> </param> - <param name="fixed_mods" format="text" type="select" multiple="true" label="Fixed Modifications" help="Hold the appropriate key while - clicking to select multiple items"> + <param name="fixed_mods" format="text" type="select" multiple="true" label="Fixed Modifications" help="Multiple values allowed"> <options from_file="mascot_mods.loc"> <column name="name" index="0" /> <column name="value" index="2" /> @@ -108,24 +150,33 @@ <option value="CID+ETD">CID+ETD</option> </param> - <param name="fragment_ion_tol" label="Fragment Ion Tolerance in Daltons" type="float" value="0.65" min="0" max="10000" help="Fragment ion tolerance in Daltons"/> + <param name="fragment_ion_tol" label="Fragment Ion Tolerance" type="float" value="0.65" min="0" max="10000" help="Fragment ion tolerance in Daltons"/> - <param name="precursor_ion_tol" label="Precursor Ion Tolerance (Da or ppm)" type="float" value="100" min="0" max="10000" help="Precursor ion tolerance"/> + <param name="precursor_ion_tol" label="Precursor Ion Tolerance (Da or ppm)" type="float" value="100" min="0" max="10000" help="Enter a value in Daltons or ppm depending on the units chosen below"/> <param name="precursor_tolu" type="select" format="text"> <label>Precursor Ion Tolerance Units</label> <option value="ppm">ppm</option> <option value="Da">Da</option> </param> - <param name="server" type="text" label="URL to Mascot Server cgi " size="60" value="http://www.exampleserver.com/mascot/cgi/"/> + <param name="server" type="text" label="URL to the cgi directory on the Mascot Server " size="60" value="http://www.exampleserver.com/mascot/cgi/"/> + <param name="proxy" type="text" label="Proxy Server URL including proxy port" size="60" value="" help="eg http://proxy.latrobe.edu.au:8080"/> + + <conditional name="security"> + <param name="security_use" type="boolean" label="Use Mascot Security?" help="Select this if you need to enter a username and password" truevalue="true" falsevalue="false" /> + <when value="false" /> + <when value="true"> + <param name="username" type="text" label="Username" size="60" value="" help="Username on Mascot Server"/> + <param name="password" type="text" label="Password" size="60" value="" help="Mascot Password. Password is encrypted when over the internet but is stored in clear-text on the Galaxy server"/> + </when> + </conditional> + <param name="email" type="text" label="Email " size="60" value="" help=""/> - <param name="email" type="text" label="Email " size="60" value="" help="Not Supported Yet."/> - <param name="username" type="text" label="Username" size="60" value="" help="Not Supported Yet."/> </inputs> <outputs> - <data format="mascotdat" name="output" metadata_source="input_file" label="mascot_vs_${database}.${input_file.display_name}.mascotdat"/> + <data format="mascotdat" name="output" metadata_source="input_file" label="mascot_vs_${database.dbkey if $database.has_key('dbkey') else $database.custom_db}.${input_file.display_name}.mascotdat"/> </outputs> <help>