Mercurial > repos > iuc > sfold
annotate sfold.xml @ 0:6cce721f568c draft default tip
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
| author | iuc |
|---|---|
| date | Wed, 27 Nov 2024 13:22:29 +0000 |
| parents | |
| children |
| rev | line source |
|---|---|
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0
6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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1 <tool id="sfold" name="Sfold" version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@" profile="@PROFILE@"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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2 <description>Prediction of RNA secondary structures through structure ensemble sampling</description> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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3 <macros> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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4 <import>macros.xml</import> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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5 </macros> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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diff
changeset
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6 <requirements> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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7 <expand macro="requirements"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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8 </requirements> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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9 <command detect_errors="exit_code"><![CDATA[ |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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diff
changeset
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10 #if not $non_commercial_use |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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11 >&2 echo "this tool is only available for non commercial use"; |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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12 exit 1; |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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13 #end if |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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14 mkdir -p 'output' && |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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15 sfold '$fasta' |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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16 -a $a |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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17 #if $f: |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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18 -f '$f' |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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19 #end if |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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20 #if str($l) != '': |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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21 -l $l |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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diff
changeset
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22 #end if |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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23 #if $m: |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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24 -m '$m' |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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25 #end if |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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26 -w $w |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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27 -i $i |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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28 ]]></command> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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29 <inputs> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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30 <param name="non_commercial_use" label="I certify that I am not using this tool for commercial purposes." type="boolean" truevalue="NON_COMMERCIAL_USE" falsevalue="COMMERCIAL_USE" checked="False"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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31 <validator type="expression" message="This tool is only available for non-commercial use.">value == True</validator> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
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changeset
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32 </param> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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33 <param argument="fasta" type="data" format="fasta" label="FASTA input"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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34 <param argument="-a" type="boolean" truevalue="1" falsevalue="0" checked="true" label="Run clustering on the sampled ensemble?"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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35 <param argument="-f" type="data" format="ct" optional="true" label="Constrain data" help="Constraint syntax follows what is used in mfold 3.1"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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36 <param argument="-l" type="integer" min="0" optional="true" label="Maximum distance between paired bases"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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37 <param argument="-m" type="data" format="ct" optional="true" label="MFE structure" help="If provided, Sfold clustering module will determine the cluster to which this structure belongs."/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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38 <param argument="-w" type="integer" value="20" label="Length of antisense oligos"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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39 <param argument="-i" type="select" label="Module"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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40 <option value="0">None</option> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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41 <option value="1">Sirna</option> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
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changeset
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42 <option value="2">Soligo</option> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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changeset
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43 <option value="3">Both</option> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
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diff
changeset
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44 </param> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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45 <param name="output_selector" type="select" multiple="true" optional="true" display="checkboxes" label="Output options"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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46 <option value="ct" selected="true">Output ct files</option> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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47 <option value="bp" selected="true">Output bp files</option> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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48 <option value="clusters">Output cluster files</option> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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49 </param> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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50 </inputs> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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51 <outputs> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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52 <collection name="sfold_out" type="list" label="${tool.name} on ${on_string}: sfold log files"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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53 <discover_datasets pattern="(?P<name>.+)\.out$" format="txt" directory="output/"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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54 </collection> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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55 <collection name="sfold_bp" type="list" label="${tool.name} on ${on_string}: sfold bp files"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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56 <discover_datasets pattern="(?P<name>.+)\.bp$" format="txt" directory="output/"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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57 <filter>'bp' in output_selector</filter> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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58 </collection> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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59 <collection name="sfold_ct" type="list" label="${tool.name} on ${on_string}: sfold ct files"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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60 <discover_datasets pattern="(?P<name>.+)\.ct$" format="ct" directory="output/"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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61 <filter>'ct' in output_selector</filter> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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62 </collection> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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63 <collection name="sfold_cluster_out" type="list" label="${tool.name} on ${on_string}: sfold cluster log files"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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64 <discover_datasets pattern="(?P<name>.+)\.out$" format="txt" directory="output/clusters"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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65 <discover_datasets pattern="(?P<name>.+)\.list$" format="txt" directory="output/clusters"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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66 <filter>'clusters' in output_selector</filter> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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67 </collection> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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68 <collection name="sfold_cluster_bp" type="list" label="${tool.name} on ${on_string}: sfold cluster bp files"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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69 <discover_datasets pattern="(?P<name>.+)\.bp$" format="txt" directory="output/clusters"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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70 <filter>'clusters' in output_selector and 'bp' in output_selector</filter> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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71 </collection> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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72 <collection name="sfold_cluster_ct" type="list" label="${tool.name} on ${on_string}: sfold cluster ct files"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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73 <discover_datasets pattern="(?P<name>.+)\.ct$" format="ct" directory="output/clusters"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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74 <filter>'clusters' in output_selector and 'ct' in output_selector</filter> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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75 </collection> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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76 </outputs> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
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77 <tests> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
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78 <test expect_num_outputs="6"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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79 <param name="non_commercial_use" value="true"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
diff
changeset
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80 <param name="fasta" value="seq.fasta"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
iuc
parents:
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81 <param name="a" value="true"/> |
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82 <param name="f" value="cons.ct"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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83 <param name="l" value="30"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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84 <param name="m" value="mfe.ct"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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85 <param name="w" value="20"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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86 <param name="i" value="1"/> |
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87 <param name="output_selector" value="ct,bp,clusters"/> |
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88 <output_collection name="sfold_out" type="list"> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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89 <element name="10structure"> |
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90 <assert_contents> |
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91 <has_n_lines n="770"/> |
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92 <has_text text="Structure 1 -28.90 0.74863E-01"/> |
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6cce721f568c
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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93 </assert_contents> |
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94 </element> |
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95 <element name="10structure_2"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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96 <assert_contents> |
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97 <has_n_lines n="10"/> |
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98 </assert_contents> |
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99 </element> |
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100 <element name="bp.dist.from.ecentroid"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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101 <assert_contents> |
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102 <has_n_lines n="1001"/> |
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103 <has_text text="1 5"/> |
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104 </assert_contents> |
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105 </element> |
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106 <element name="bp"> |
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107 <assert_contents> |
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108 <has_text text="Structure 1"/> |
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109 </assert_contents> |
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110 </element> |
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111 <element name="bprob"> |
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112 <assert_contents> |
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113 <has_n_lines n="4"/> |
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114 <has_text text=".16225072123690604808E+01L"/> |
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115 </assert_contents> |
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116 </element> |
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117 <element name="cdf"> |
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118 <assert_contents> |
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119 <has_n_lines n="101"/> |
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120 </assert_contents> |
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121 </element> |
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122 <element name="fe"> |
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123 <assert_contents> |
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124 <has_n_lines n="1000"/> |
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125 <has_text text="1 -28.70"/> |
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126 </assert_contents> |
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127 </element> |
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128 <element name="fe_init"> |
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129 <assert_contents> |
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130 <has_n_lines n="1002"/> |
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131 <has_text text="Ensemble free energy (based on initial energies):-RT ln(U)= -28.297589224477537 "/> |
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132 </assert_contents> |
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133 </element> |
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134 <element name="loopr"> |
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135 <assert_contents> |
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136 <has_n_lines n="76"/> |
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137 </assert_contents> |
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138 </element> |
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139 <element name="pdf"> |
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140 <assert_contents> |
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141 <has_n_lines n="21"/> |
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142 </assert_contents> |
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143 </element> |
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144 <element name="sample"> |
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145 <assert_contents> |
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146 <has_n_lines n="1"/> |
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147 <has_text text="Structure data in BP format removed to"/> |
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148 </assert_contents> |
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149 </element> |
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150 <element name="sample_1000"> |
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151 <assert_contents> |
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152 <has_text text="(i j k): helix formed by base pairs i-j, (i+1)-(j-1),...,(i+k-1)-(j-k+1)"/> |
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153 </assert_contents> |
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154 </element> |
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155 <element name="sclass"> |
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156 <assert_contents> |
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157 <has_text text="Sequence length = 76"/> |
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158 </assert_contents> |
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159 </element> |
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160 <element name="sfold"> |
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161 <assert_contents> |
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162 <has_n_lines n="42"/> |
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163 <has_text text="1 G"/> |
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164 </assert_contents> |
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165 </element> |
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166 <element name="smfe"> |
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167 <assert_contents> |
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168 <has_n_lines n="2"/> |
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169 <has_text text="Minimum free energy in the sample (SMFE)= -28.90 kcal/mol"/> |
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170 </assert_contents> |
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171 </element> |
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172 <element name="sstrand"> |
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173 <assert_contents> |
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174 <has_n_lines n="76"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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175 </assert_contents> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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176 </element> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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177 </output_collection> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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178 <output_collection name="sfold_bp" type="list"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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179 <element name="ecentroid"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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180 <assert_contents> |
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181 <has_text text="1 72"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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182 </assert_contents> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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183 </element> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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184 </output_collection> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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185 <output_collection name="sfold_ct" type="list"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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186 <element name="ecentroid"> |
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187 <assert_contents> |
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188 <has_n_lines n="78"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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189 </assert_contents> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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190 </element> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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191 </output_collection> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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192 <output_collection name="sfold_cluster_out" type="list"> |
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193 <element name="c01.2dhist"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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194 <assert_contents> |
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195 <has_text text="1"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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196 </assert_contents> |
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197 </element> |
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198 <element name="c01.bp.dist.from.ccentroid"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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199 <assert_contents> |
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200 <has_text text="1"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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201 </assert_contents> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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202 </element> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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203 <element name="c01.bp"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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204 <assert_contents> |
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205 <has_text text="Structure 1"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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206 </assert_contents> |
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207 </element> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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208 <element name="c01.fe"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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209 <assert_contents> |
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210 <has_text text=" 1"/> |
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211 </assert_contents> |
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212 </element> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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213 <element name="c02.2dhist"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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214 <assert_contents> |
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215 <has_text text="72"/> |
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216 </assert_contents> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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217 </element> |
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218 <element name="c02.bp.dist.from.ccentroid"> |
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219 <assert_contents> |
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220 <has_text text="1"/> |
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221 </assert_contents> |
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222 </element> |
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223 <element name="c02.bp"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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224 <assert_contents> |
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225 <has_text text="Structure 1"/> |
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226 </assert_contents> |
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227 </element> |
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228 <element name="c02.fe"> |
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229 <assert_contents> |
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230 <has_text text="10"/> |
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231 </assert_contents> |
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232 </element> |
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233 <element name="ch.index"> |
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234 <assert_contents> |
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235 <has_n_lines n="19"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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236 </assert_contents> |
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237 </element> |
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238 </output_collection> |
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239 <output_collection name="sfold_cluster_bp" type="list"> |
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240 <element name="c01.ccentroid"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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241 <assert_contents> |
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242 <has_text text="1 72"/> |
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243 </assert_contents> |
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244 </element> |
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245 <element name="c02.ccentroid"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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246 <assert_contents> |
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247 <has_text text="Structure 1"/> |
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248 </assert_contents> |
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249 </element> |
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250 </output_collection> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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251 <output_collection name="sfold_cluster_ct" type="list"> |
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252 <element name="c01.ccentroid"> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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253 <assert_contents> |
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254 <has_n_lines n="78"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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255 <has_text text="Length: 76"/> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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256 </assert_contents> |
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planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/sfold commit 41456127d154f251438945210c2513601bd21ceb
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257 </element> |
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258 <element name="c02.ccentroid"> |
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259 <assert_contents> |
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260 <has_n_lines n="78"/> |
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261 <has_text text="Length: 76"/> |
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262 </assert_contents> |
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263 </element> |
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264 </output_collection> |
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265 </test> |
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266 <test expect_num_outputs="4"> |
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267 <param name="non_commercial_use" value="true"/> |
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268 <param name="fasta" value="seq.fasta"/> |
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269 <param name="a" value="true"/> |
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270 <param name="f" value="cons.ct"/> |
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271 <param name="l" value="30"/> |
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272 <param name="m" value="mfe.ct"/> |
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273 <param name="w" value="20"/> |
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274 <param name="i" value="1"/> |
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275 <param name="output_selector" value="bp,clusters"/> |
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276 <output_collection name="sfold_cluster_bp" type="list"> |
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277 <element name="c01.ccentroid"> |
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278 <assert_contents> |
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279 <has_text text="1 72"/> |
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280 </assert_contents> |
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281 </element> |
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282 <element name="c02.ccentroid"> |
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283 <assert_contents> |
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284 <has_text text="Structure 1"/> |
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285 </assert_contents> |
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286 </element> |
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287 </output_collection> |
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288 <output_collection name="sfold_bp" type="list"> |
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289 <element name="ecentroid"> |
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290 <assert_contents> |
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291 <has_text text="1 72"/> |
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292 </assert_contents> |
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293 </element> |
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294 </output_collection> |
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295 </test> |
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296 </tests> |
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297 <help><![CDATA[ |
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298 Sfold is a software package for statistical folding and rational design of nucleic acids. |
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299 |
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300 It provides tools for predicting RNA secondary structures, designing antisense oligonucleotides, and analyzing RNA folding patterns. Sfold is widely used in academic research for studying |
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301 RNA structure and function. |
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302 |
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303 Input Format |
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304 |
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305 ----------- |
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306 |
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307 The program requires one input file of RNA sequence in FASTA format. |
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308 |
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309 Sfold options |
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310 |
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311 ------------ |
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312 |
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313 The program can run based on the clustering on the sampled ensemble or not. |
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314 It can also predict the secondary structure based on the constraint and MFE structure files. |
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315 The sfold has two different modules: |
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316 |
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317 * SiRNA : Target accessibility prediction and RNA duplex thermodynamics for rational siRNA design |
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318 * Solig: Target accessibility prediction and rational design of antisense oligonucleotides and nucleic acid probes |
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319 |
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320 The program can be run based on the above-mentioned modules, both of them or none of them. |
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321 |
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322 Output Files |
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323 |
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324 ------------ |
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325 |
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326 The Sfold program generates 4 different types of output files. sfold.out and sclass.out in your output log files, save the general messages from standard output/error from which you can know if your Sfold run was successful. Most of the other |
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327 files contain a header section that defines the formats and meanings of the data in the output. |
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328 |
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329 ------------ |
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330 |
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331 Important: The program usage is restricted to non-commercial and academic research. |
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332 ]]> |
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333 </help> |
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334 <expand macro="citations" /> |
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335 </tool> |
