Mercurial > repos > chemteam > gmx_md

changeset 1:da365d0a1363 draft

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planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tools/gromacs commit 4546df85653df59e357c5865ac4e538ea71a3048
author chemteam
date Thu, 04 Oct 2018 18:19:24 -0400
parents 4ce8938edbf3
children 47a54de4f9f6
files macros.xml md.xml
diffstat 2 files changed, 0 insertions(+), 4 deletions(-) [+]
line wrap: on
line diff
--- a/macros.xml	Thu Oct 04 17:37:42 2018 -0400
+++ b/macros.xml	Thu Oct 04 18:19:24 2018 -0400
@@ -10,8 +10,6 @@
             <citation type="doi">10.1016/j.softx.2015.06.001</citation>
         </citations>
     </xml>
-    
-    
     <xml name="md_inputs">
         <conditional name="mdp">
             <param name="mdpfile" type="select" label="Parameter input">
--- a/md.xml	Thu Oct 04 17:37:42 2018 -0400
+++ b/md.xml	Thu Oct 04 18:19:24 2018 -0400
@@ -3,9 +3,7 @@
     <macros>
         <import>macros.xml</import>
     </macros>
-
     <expand macro="requirements" />
-
     <command detect_errors="exit_code"><![CDATA[
         #if $mdp.mdpfile == "custom":
             ln -s '$mdp.mdp_input' ./md.mdp &&