Mercurial > repos > recetox > rem_complex
annotate macros.xml @ 3:567327a97ad2 draft
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 4b8a43b863ff8a0ff1d5a08e516068853adf358d
| author | recetox |
|---|---|
| date | Tue, 16 Apr 2024 11:30:27 +0000 |
| parents | a0e07a0bc047 |
| children |
| rev | line source |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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1 <macros> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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2 <token name="@TOOL_VERSION@">1.0.0</token> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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3 <xml name="creator"> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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4 <creator> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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5 <person |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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6 givenName="Wudmir" |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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7 familyName="Rojas" |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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8 url="https://github.com/wverastegui" |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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9 identifier="0000-0001-7036-9987" /> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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10 <person |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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11 givenName="Helge" |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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12 familyName="Hecht" |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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13 url="https://github.com/hechth" |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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14 identifier="0000-0001-6744-996X" /> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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15 <organization |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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16 url="https://www.recetox.muni.cz/" |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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17 email="GalaxyToolsDevelopmentandDeployment@space.muni.cz" |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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18 name="RECETOX MUNI"/> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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19 </creator> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
parents:
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20 </xml> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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21 <token name="@HELP@"><![CDATA[ |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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22 The remove complex tool filters out coordination complexes from a list of SMLES or InChI. |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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23 |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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24 Documentation |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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25 The rem complex tool removes coordination complexes from a list of SMLES or InChI. The tool accepts input files with csv, smi and inchi formats, |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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changeset
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26 and returns the same format as the input file. The tool is based on the openbabel python library. |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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27 ]]> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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28 </token> |
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a0e07a0bc047
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit 833f7671d1e1b713d52ba5c7e59d28be38b92b1e
recetox
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29 </macros> |
