Mercurial > repos > bgruening > rxdock_rbdock

comparison rbdock.xml @ 3:b34d068c2782 draft default tip

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
author bgruening
date Tue, 28 Jul 2020 08:45:49 -0400
parents 6fe6b0e10ed6
children
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2:6fe6b0e10ed6 3:b34d068c2782
1 <tool id="rxdock_rbdock" name="rxDock docking" version="0.1.5" profile="19.01"> 1 <tool id="rxdock_rbdock" name="rxDock docking" version="@TOOL_VERSION@+galaxy@GALAXY_VERSION@">
2 <description>- perform protein-ligand docking with rxDock</description> 2 <description>- perform protein-ligand docking with rxDock</description>
3 <macros> 3 <macros>
4 <import>rxdock_macros.xml</import> 4 <import>rxdock_macros.xml</import>
5 <token name="@GALAXY_VERSION@">0</token>
5 </macros> 6 </macros>
6 <expand macro="requirements"/> 7 <expand macro="requirements"/>
7 <command><![CDATA[ 8 <command><![CDATA[
8 ln -s '$active_site' receptor.as && 9 ln -s '$active_site' receptor.as &&
9 ln -s '$receptor' receptor.mol2 && 10 ln -s '$receptor' receptor.mol2 &&