Mercurial > repos > recetox > rem_complex
comparison rem_complex.xml @ 4:60db8070a5c3 draft default tip
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit d42dca433f84f2540d0901a8add71d01637f5179
author | recetox |
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date | Tue, 11 Jun 2024 09:10:34 +0000 |
parents | 567327a97ad2 |
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3:567327a97ad2 | 4:60db8070a5c3 |
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1 <tool id="rem_complex" name="Remove coordination complexes" version="@TOOL_VERSION@+galaxy3" profile="21.09"> | 1 <tool id="rem_complex" name="Remove coordination complexes" version="@TOOL_VERSION@+galaxy4" profile="21.09"> |
2 <description>Remove molecular coordination complexes from a list of structure representations</description> | 2 <description>Remove molecular coordination complexes from a list of structure representations</description> |
3 <macros> | 3 <macros> |
4 <import>macros.xml</import> | 4 <import>macros.xml</import> |
5 </macros> | 5 </macros> |
6 <expand macro="creator"/> | |
6 <requirements> | 7 <requirements> |
7 <requirement type="package" version="1.5.3">pandas</requirement> | 8 <requirement type="package" version="1.5.3">pandas</requirement> |
8 <requirement type="package" version="3.1.1">openbabel</requirement> | 9 <requirement type="package" version="3.1.1">openbabel</requirement> |
9 </requirements> | 10 </requirements> |
10 | 11 |