annotate macros.xml @ 10:821062fc5782 draft default tip

planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 2b8b1dcb2947c6503fd4f82904df708e4f88ea1d
author recetox
date Fri, 04 Jul 2025 09:43:22 +0000
parents 6fc9f6dbcef5
children
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0
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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1 <macros>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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2 <token name="@TOOL_VERSION@">0.2.0</token>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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3
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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4 <xml name="creator">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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5 <creator>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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6 <person
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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7 givenName="Maksym"
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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8 familyName="Skoryk"
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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9 url="https://github.com/maximskorik"
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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10 identifier="0000-0003-2056-8018" />
1
b77023c41c76 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit d82e7dad96bebe9424ac7bf490e2786d82c3681a
recetox
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11 <person
b77023c41c76 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit d82e7dad96bebe9424ac7bf490e2786d82c3681a
recetox
parents: 0
diff changeset
12 givenName="Zargham"
b77023c41c76 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit d82e7dad96bebe9424ac7bf490e2786d82c3681a
recetox
parents: 0
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13 familyName="Ahmad"
b77023c41c76 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit d82e7dad96bebe9424ac7bf490e2786d82c3681a
recetox
parents: 0
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14 url="https://github.com/zargham-ahmad"
b77023c41c76 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit d82e7dad96bebe9424ac7bf490e2786d82c3681a
recetox
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15 identifier="0000-0002-6096-224X" />
0
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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16 <organization
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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17 url="https://www.recetox.muni.cz/"
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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18 email="GalaxyToolsDevelopmentandDeployment@space.muni.cz"
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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19 name="RECETOX MUNI" />
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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20 </creator>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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21 </xml>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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22
2
6480c6d5fa36 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 77bea6c84c5a932fa203723d4d5fea6147f06505
recetox
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23 <xml name="annotation">
6480c6d5fa36 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 77bea6c84c5a932fa203723d4d5fea6147f06505
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24 <xrefs>
9
6fc9f6dbcef5 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit bbcbf9c32acaedffb78f0caef47faeed8f68cb52
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25 <xref type="bio.tools">waveica</xref>
2
6480c6d5fa36 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 77bea6c84c5a932fa203723d4d5fea6147f06505
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26 </xrefs>
6480c6d5fa36 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 77bea6c84c5a932fa203723d4d5fea6147f06505
recetox
parents: 1
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27 </xml>
6480c6d5fa36 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 77bea6c84c5a932fa203723d4d5fea6147f06505
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28
0
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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29 <xml name="wf">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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30 <conditional name="wf">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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31 <param type="select" name="wavelet_filter" label="Wavelet transform filter" help="wavelet function and filter length [1] (see footnotes for more details)">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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32 <option value="d" selected="True">Daubechies</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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33 <option value="la" >Least Asymetric</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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34 <option value="bl" >Best Localized</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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35 <option value="c" >Coiflet</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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36 </param>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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diff changeset
37 <when value="d">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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38 <param name="wavelet_length" type="select" label="filter length">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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diff changeset
39 <option value="2" selected="True">2</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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40 <option value="4">4</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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41 <option value="6">6</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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42 <option value="8">8</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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43 <option value="10">10</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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44 <option value="12">12</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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45 <option value="14">14</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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46 <option value="16">16</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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47 <option value="18">18</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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48 <option value="20">20</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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49 </param>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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50 </when>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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diff changeset
51 <when value="la">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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diff changeset
52 <param name="wavelet_length" type="select" label="filter length">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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53 <option value="8">8</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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54 <option value="10">10</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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55 <option value="12">12</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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diff changeset
56 <option value="14">14</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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diff changeset
57 <option value="16">16</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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diff changeset
58 <option value="18">18</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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59 <option value="20">20</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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60 </param>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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61 </when>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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diff changeset
62 <when value="bl">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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63 <param name="wavelet_length" type="select" label="filter length">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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64 <option value="14">14</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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65 <option value="18">18</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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66 <option value="20">20</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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67 </param>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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68 </when>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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diff changeset
69 <when value="c">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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diff changeset
70 <param name="wavelet_length" type="select" label="filter length">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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71 <option value="6">6</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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72 <option value="12">12</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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73 <option value="18">18</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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74 <option value="24">24</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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75 <option value="30">30</option>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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76 </param>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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77 </when>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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78 </conditional>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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79 </xml>
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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80
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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81 <xml name="outputs">
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
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82 <outputs>
7
1a2aeb8137bf planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 013d7c85fa9d77b8a27d194b350cd6b2d127a80f
recetox
parents: 4
diff changeset
83 <data name="normalized_data" format="tabular" label="Normalized table of ${on_string}">
1a2aeb8137bf planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 013d7c85fa9d77b8a27d194b350cd6b2d127a80f
recetox
parents: 4
diff changeset
84 <change_format>
10
821062fc5782 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 2b8b1dcb2947c6503fd4f82904df708e4f88ea1d
recetox
parents: 9
diff changeset
85 <when input_dataset="data_matrix" attribute="ext" value="parquet" format="parquet" />
821062fc5782 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 2b8b1dcb2947c6503fd4f82904df708e4f88ea1d
recetox
parents: 9
diff changeset
86 <when input_dataset="data_matrix" attribute="ext" value="csv" format="csv" />
821062fc5782 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 2b8b1dcb2947c6503fd4f82904df708e4f88ea1d
recetox
parents: 9
diff changeset
87 <when input_dataset="data_matrix" attribute="ext" value="tsv" format="tsv" />
821062fc5782 planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 2b8b1dcb2947c6503fd4f82904df708e4f88ea1d
recetox
parents: 9
diff changeset
88 <when input_dataset="data_matrix" attribute="ext" value="tabular" format="tabular" />
4
425c0494ec2d planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 84de3bc96ad2859d87c70ba94d8ceb0b2bc2a0da
recetox
parents: 2
diff changeset
89 </change_format>
425c0494ec2d planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 84de3bc96ad2859d87c70ba94d8ceb0b2bc2a0da
recetox
parents: 2
diff changeset
90 </data>
0
328710890963 "planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/waveica commit 98e541a75678eee749261630610b946c258fd5f3"
recetox
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91 </outputs>
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92 </xml>
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93
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94 <token name="@HELP@"><![CDATA[
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95 **Description**
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96
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97 Removal of batch effects for large-scale untargeted metabolomics data based on wavelet analysis and independent
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98 component analysis. The WaveICA method uses the time trend of samples over the injection order, decomposes the
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99 original data into new multi-scale features, extracts and removes the batch effect resulting in normalized
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100 intensities across samples.
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101
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102 The input is an intensity-by-feature table with metadata in the following format:
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103
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104 +---------------+--------+------------+----------------+-------+------------+--------------+-------------+-------------+-----+
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105 | sampleName | class | sampleType | injectionOrder | batch | M85T34 | M86T41 | M86T518 | M86T539 | ... |
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106 +===============+========+============+================+=======+============+==============+=============+=============+=====+
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107 | VT_160120_002 | sample | sample | 1 | 1 | 228520.064 | 35646729.215 | 2386896.979 | 1026645.836 | ... |
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108 +---------------+--------+------------+----------------+-------+------------+--------------+-------------+-------------+-----+
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109 | QC1 | sample | QC | 2 | 1 | 90217.384 | 35735702.457 | 2456290.696 | 1089246.460 | ... |
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110 +---------------+--------+------------+----------------+-------+------------+--------------+-------------+-------------+-----+
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111 | ... | ... | ... | ... | ... | ... | ... | ... | ... | ... |
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112 +---------------+--------+------------+----------------+-------+------------+--------------+-------------+-------------+-----+
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113
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114
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115 + The required columns are **sampleName**, **class**, **sampleType**, **injectionOrder**, and the **features** that you want to normalize.
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116 + The **batch** column is required if batch correction mode is **Multiple batches** and optional otherwise.
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117 + The presence of any additional columns (except features) will result in incorrect batch correction or job failure.
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118 + the input table must not contain missing values. Missing intensities must be filled with 0.
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119 + **sampleType** column accepts three possible values: [QC, sample, blank] (case insensitive).
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120 + **class** column is used to denote a biological group of a sample (e.g., positive/negative species). The column accepts any values.
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121 + the **output** is the same table with corrected feature intensities.
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122
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123 .. rubric:: **Footnotes**
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124 .. [1] for details on wavelet-filter parameters refer to R `wavelets::wt.filter <https://www.rdocumentation.org/packages/wavelets/versions/0.3-0.2/topics/wt.filter>`_;
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125 .. [2] when using 'Multiple batches', please cite the WaveICA (2019) paper; else, cite WaveICA 2.0 (2021) paper;
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126 ]]>
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127 </token>
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128 </macros>