annotate plates_generator.xml @ 0:5735a13c1f5b draft

planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
author tduigou
date Tue, 28 Mar 2023 12:35:56 +0000
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children bd72cb677e4e
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5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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1 <tool id="icfree_plates_generator" name="iCFree plates generator" version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@" license="@LICENCE@">
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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2 <description>Generates a list of Echo-compatible source and destination plates according a set of samples to test</description>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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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 <command detect_errors="exit_code"><![CDATA[
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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9 #set factors = []
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10 #for $x in $adv.rep
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11 #silent factors.append(str($x.optimize_well_volumes))
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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12 #end for
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13 #set sfactors = ' '.join(['"' + $x + '"' for $x in $factors])
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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14 python -m icfree.plates_generator
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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15 '$cfps_file'
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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16 '$volume_file'
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17 --sample_volume '$adv.sample_volume'
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18 --source_plate_dead_volume '$adv.source_plate_dead_volume'
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19 --dest_plate_dead_volume '$adv.dest_plate_dead_volume'
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20 --dest-starting_well '$adv.dest_starting_well'
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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21 --src-starting_well '$adv.src_starting_well'
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22 --nplicate '$adv.nplicate'
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23 --keep-nil-vol '$adv.keep_nil_vol'
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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24 --source_plate_well_capacity '$adv.source_plate_well_capacity'
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25 --dest_plate_well_capacity '$adv.dest_plate_well_capacity'
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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26 #if len(factors) > 0
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27 --optimize-well-volumes ${sfactors}
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28 #end if
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29 --plate-dimensions '$adv.plate_dimensions'
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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30 --output-folder '.'
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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31 --output-format 'tsv' &&
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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32 mv volumes_summary.tsv '$volumes_summary'
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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33 ]]></command>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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34 <inputs>
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35 <param name="cfps_file" type="data" format="tabular" label="CFPS parameters and features" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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36 <param name="volume_file" type="data" format="tabular" label="Volumes" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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37
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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38 <section name="adv" title="Advanced Options" expanded="false">
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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39
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40 <param name="sample_volume" type="integer" value="1000" label="Final sample volume in each well in nL" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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41 <param name="source_plate_dead_volume" type="integer" value="15000" label="Dead volume to add in the source plate in nL"/>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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42 <param name="dest_plate_dead_volume" type="integer" value="15000" label="Dead volume to add in the destination plate in nL"/>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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43
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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44 <param name="dest_starting_well" type="text" value="A1" label="Starter well of destination plate to begin filling the 384 well-plate">
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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45 <validator type="empty_field" message="Not empty"/>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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46 <validator type="regex" message="Some letters followed by a number">^(?:[A-K]{1}([1-9]|1[0-2]))$</validator>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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47 </param>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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48 <param name="src_starting_well" type="text" value="A1" label="Starter well of source plate to begin filling the 384 well-plate">
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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49 <validator type="empty_field" message="Not empty"/>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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50 <validator type="regex" message="Some letters followed by a number">^(?:[A-K]{1}([1-9]|1[0-2]))$</validator>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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51 </param>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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52
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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53 <param name="nplicate" type="integer" value="3" min="1" max="12" label="Numbers of copies of volume sets"/>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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54 <param name="keep_nil_vol" type="boolean" truevalue="True" falsevalue="False" checked="true" display="checkboxes" label="Keep nil volumes in instructions or not"/>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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55
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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56 <param name="source_plate_well_capacity" type="integer" value="60000" label="Maximum volume capacity of the source plate in nL" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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57 <param name="dest_plate_well_capacity" type="integer" value="60000" label="Maximum volume capacity of the dest plate in nL" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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58 <param name="plate_dimensions" type="text" value="16x24" label="Dimensions of plate separated by a 'x'">
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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59 <validator type="empty_field" message="Not empty"/>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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60 <validator type="regex" message="An 'x' separator is expected">^(?:\d+x\d+)$</validator>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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61 </param>
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62 <repeat name="rep" title="Optimize well volumes" min="0">
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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63 <param name="optimize_well_volumes" type="text" value="" label="Save volumes in source plate for all factors">
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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64 <validator type="empty_field" message="Not empty"/>
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65 </param>
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66 </repeat>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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67
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68 </section>
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69 </inputs>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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70 <outputs>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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71 <data name="volumes_summary" format="tabular" label="${tool.name} - Volumes" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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72 <collection name="output_source_dest" type="list" label="${tool.name} - Source Destination Plate">
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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73 <discover_datasets pattern="(?P&lt;name&gt;source_plate_\d+\.json)$" format="json" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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74 <discover_datasets pattern="(?P&lt;name&gt;source_plate_\d+\.tsv)$" format="tabular" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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75 <discover_datasets pattern="(?P&lt;name&gt;destination_plate_\d+\.json)$" format="json" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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76 <discover_datasets pattern="(?P&lt;name&gt;destination_plate_\d+\.tsv)$" format="tabular" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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77 </collection>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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78 </outputs>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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79 <tests>
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80 <!-- test 1: check if identical outputs are produced with default parameters -->
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81 <test>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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82 <param name="cfps_file" value="converter_proCFPS_parameters.tsv" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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83 <param name="volume_file" value="converter_sampling_concentrations.tsv" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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84 <output name="volumes_summary" file="plates_generator_volumes_summary.test-1.tsv" ftype="tabular" compare="diff" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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85 <output_collection name="output_source_dest" type="list" count="4">
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86 <element name="source_plate_1.json" ftype="json">
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87 <assert_contents>
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88 <has_n_lines n="26"/>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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89 </assert_contents>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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90 </element>
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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91 <element name="source_plate_1.tsv" file="plates_generator_source_plate_1.test-1.tsv" ftype="tabular" compare="diff" />
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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92 <element name="destination_plate_1.json" ftype="json">
5735a13c1f5b planemo upload for repository https://github.com/brsynth/icfree-ml commit e908694368c306390bc9253f81a9249ad988970d
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93 <assert_contents>
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94 <has_n_lines n="26"/>
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95 </assert_contents>
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96 </element>
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97 <element name="destination_plate_1.tsv" file="plates_generator_destination_plate_1.test-1.tsv" ftype="tabular" compare="diff" />
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98 </output_collection>
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99 </test>
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100 <!-- test 2: advance arguments -->
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101 <test>
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102 <param name="cfps_file" value="converter_proCFPS_parameters.tsv" />
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103 <param name="volume_file" value="converter_sampling_concentrations.tsv" />
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104 <param name="source_plate_dead_volume" value="1500" />
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105 <param name="dest_plate_dead_volume" value="1000" />
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106 <param name="dest_starting_well" value="C3" />
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107 <param name="src_starting_well" value="A2" />
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108 <param name="nplicate" value="2" />
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109 <param name="keep_nil_vol" value="False" />
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110 <param name="plate_dimensions" value="32x32" />
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111 <repeat name="rep">
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112 <param name="optimize_well_volumes" value="RBS" />
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113 </repeat>
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114 <repeat name="rep">
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115 <param name="optimize_well_volumes" value="Promoter" />
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116 </repeat>
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117 <output_collection name="output_source_dest" type="list" count="4">
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118 <element name="destination_plate_1.tsv" file="plates_generator_destination_plate_1.test-2.tsv" ftype="tabular" compare="diff" />
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119 </output_collection>
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120 </test>
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121 </tests>
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122 <help><![CDATA[
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123 Plates Generator
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124 ================
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125
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126 This module generates a list of source and destination plates according to the set of samples to test.
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127
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128 Input
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129 -----
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130 * **CFPS Parameters File**: The first column is the parameter (or factor) names. The second column is the maxValue of the parameter that will be used in the sampling. The third column is the concnetration of the stock. The fourth column is the deadVolume of the parameter. This is used to calculate the volume of the parameter that will not be pipetted by the robot (because of viscosity). The fifth column is the specific ratios we want to have for this parameter. If nothing defined, then take ratios given in program options. If one single number is given, then take this number as a const value.
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131 * Volume File**: File containing volumes
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132
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133 Advanced Options:
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134 -----------------
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135 * **Sample Volume**: Final sample volume in each well in nL (default: 10000)
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136 * **Source Plate Dead Volume**: dead volume to add in the source plate in nL (default: 15000)
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137 * **Destination Plate Dead Volume**: dead volume to add in the dest plate in nL (default: 15000)
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138 * **Destination Starting Well**: starter well of destination plate to begin filling the 384 well-plate. (default: A1)
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139 * **Source Starting Well**: starter well of source plate to begin filling the 384 well-plate. (default: A1)
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140 * **Number of replicate**: Numbers of copies of volume sets (default: 3)
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141 * **Keep nil volumes**: Keep nil volumes in instructions or not (default: yes)
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142 * **Source Plate Well Capacity**: Maximum volume capacity of the source plate in nL (default: 60000)
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143 * **Destiantion Plate Well Capacity**: Maximum volume capacity of the dest plate in nL (default: 60000)
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144 * **Optimize Well Volumes**: Save volumes in source plate for all factors. It may trigger more volume pipetting warnings. If list of factors is given (separated by blanks), save: only for these ones (default: []).
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145 * **Plate Dimensions**: Dimensions of plate separated by a 'x', e.g. nb_rows x nb_cols (default: 16x24).
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146
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147 Output
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148 ------
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149 * **Collection**: Collection of files describing source/destination plates/wells
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150 ]]></help>
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151 <expand macro="creator"/>
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152 <expand macro="citation"/>
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153 </tool>