--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/rpbasicdesign.xml	Wed Dec 15 15:10:43 2021 +0000
@@ -0,0 +1,121 @@
+<tool id="rpbasicdesign" name="BasicDesign" version="0.3.4">
+    <description>Build DNA-BOT input files from rpSBML</description>
+    <requirements>
+        <requirement type="package" version="0.3.4">rpbasicdesign</requirement>
+    </requirements>
+    <command detect_errors="exit_code"><![CDATA[
+        python -m rpbasicdesign.cli
+        --rpsbml_file '$rpsbml_file'
+        #if $adv.parts_files
+            #set files = '" "'.join([str($file) for $file in $adv.parts_files])
+            --parts_files "${files}"
+        #end if
+        --lms_id '$adv.lms_id'
+        --lmp_id '$adv.lmp_id'
+        --backbone_id '$backbone_id'
+        --sample_size '$sample_size'
+        #if str($adv.cds_permutation) == "true"
+            --cds_permutation true
+        #else
+            --cds_permutation false
+        #end if
+        --o_dnabot_dir 'out/dnabot_in'
+        --o_sbol_dir 'out/sbol_export'
+    ]]></command>
+    <inputs>
+        <param name="rpsbml_file" type="data" format="xml" label="rpSBML file"/>
+        <param name="backbone_id" type="text" value="BASIC_SEVA_37_CmR-p15A.1" label="Backbone part ID" />
+        <param name="sample_size" type="integer" value="88" label="Number of constructs to generate" />
+        <section name="adv" title="Advanced Options" expanded="false">
+            <param name="parts_files" type="data" format="csv" optional="true" multiple="true" label="Linkers and user parts" />
+            <param name="lms_id" type="text" value="LMS" label="LMS part ID" />
+            <param name="lmp_id" type="text" value="LMP" label="LMP part ID" />
+            <param name="cds_permutation" type="boolean" label="Perform CDS permutation?" checked="true" />
+        </section>
+    </inputs>
+    <outputs>
+        <data name="Constructs" format="csv" from_work_dir="out/dnabot_in/constructs.csv" label="${tool.name} - ${rpsbml_file.name}: constructs" />
+        <data name="User parts plate" format="csv" from_work_dir="out/dnabot_in/user_parts_plate.csv" label="${tool.name} - ${rpsbml_file.name}: User parts plate"/>
+        <data name="Biolegio plate" format="csv" from_work_dir="out/dnabot_in/biolegio_plate.csv" label="${tool.name} - ${rpsbml_file.name}: Biolegio plate"/>
+        <collection name="sbol_dir" type="list" label="${tool.name} - ${rpsbml_file.name}: SBOL constructs">
+            <discover_datasets pattern="__designation_and_ext__" format="xml" directory="out/sbol_export" />
+        </collection>
+    </outputs>
+    <tests>
+        <test>
+        <!-- test 1: check if identical outputs are produced -->
+        <param name="rpsbml_file" value="lycopene_CrtEBI_from_selenzy.xml" />
+        <param name="sample_size" value="3" />
+        <output name="Constructs" file="constructs.csv" ftype="csv" compare="diff"/>
+        <output name="User parts plate" file="user_parts_plate.csv" ftype="csv" compare="diff"/>
+        <output name="Biolegio plate" file="biolegio_plate.csv" ftype="csv" compare="diff"/>
+        <output_collection name="sbol_dir" type="list">
+            <element name="BASIC_construct_A1" ftype="xml" value="BASIC_construct_A1.xml" sort="true"/>
+            <element name="BASIC_construct_B1" ftype="xml" value="BASIC_construct_B1.xml" sort="true"/>
+            <element name="BASIC_construct_C1" ftype="xml" value="BASIC_construct_C1.xml" sort="true"/>
+        </output_collection>
+        </test>
+    </tests>
+    <help><![CDATA[
+rpbasicdesign
+================
+
+Convert rpSBML enzyme info in to BASIC construct. UniProt IDs corresponding
+enzyme variants are extracted rpSBMl files. Promoters and RBSs are randomly
+chosen from a default list. CDSs, in other words gene variants, of enzymes are
+randomly chosen from amongst the UniProt IDs extracted. Constructs generated
+can be stored as (i) a CSV file ready to be used by DNA-Bot, (ii) as SBOL
+files.
+
+Input
+-----
+
+Required:
+
+* **rpsbml_file**\ : (string) rpSBML file from which enzymes UniProt IDs will be collected.
+
+Advanced options:
+
+* **parts_files**\ : (string) List of files providing available linkers and user parts (backbone, promoters, ...) for constructs. Default: [data/biolegio_parts.csv, user_parts.csv]
+* **lms_id**\ : (string) part ID to be used as the LMS methylated linker. Default: LMS.
+* **lmp_id**\ : (string) part ID to be used as the LMP methylated linker. Default: LMP.
+* **backbone_id**\ : (string) part ID to be used as the backbone. Default: BASIC_SEVA_37_CmR-p15A.1.
+* **sample_size**\ : (int) Number of construct to generate.Default: 3.
+* **cds_permutation**\ : (boolean) Whether all combinations of CDS permutation should be built Default: true.
+
+Output
+------
+
+* **o_dnabot_dir**\ : (string) Output folder to write construct and plate files. It will be created if it does not exist yet. Existing files will be overwritten. Default: out/dnabot_in.
+* **o_sbol_dir**\ : (string) Output folder to write SBOL depictions of constructs. It will be created if it does not exist yet. Existing files will be overwritten. Default: out/sbol_export.
+
+Project Links
+------------------
+
+* `GitHub <https://github.com/brsynth/rpbasicdesign>`_
+
+License
+-------
+
+* `MIT <https://github.com/brsynth/rpbasicdesign/blob/master/LICENSE.txt>`_
+
+    ]]></help>
+    <citations>
+        <citation type="bibtex">
+      @article{10.1093/synbio/ysaa010,
+          author = {Storch, Marko and Haines, Matthew C and Baldwin, Geoff S},
+          title = {DNA-BOT: a low-cost, automated DNA assembly platform for synthetic biology},
+          journal = {Synthetic Biology},
+          volume = {5},
+          number = {1},
+          year = {2020},
+          month = {07},
+          issn = {2397-7000},
+          doi = {10.1093/synbio/ysaa010},
+          url = {https://doi.org/10.1093/synbio/ysaa010},
+          note = {ysaa010},
+          eprint = {https://academic.oup.com/synbio/article-pdf/5/1/ysaa010/33722340/ysaa010.pdf},
+      }
+        </citation>
+    </citations>
+</tool>
\ No newline at end of file