Mercurial > repos > bgruening > openbabel_spectrophore_search

diff macros.xml @ 13:9ce9f996b941 draft

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 1fe240ef0064a1a4a66d9be1ccace53824280b75"
author bgruening
date Mon, 19 Oct 2020 14:41:00 +0000
parents afd14e10a318
children 330514267c57
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line diff
--- a/macros.xml	Tue Jul 28 08:35:45 2020 -0400
+++ b/macros.xml	Mon Oct 19 14:41:00 2020 +0000
@@ -18,6 +18,11 @@
         help="Valid file types are: SDF, MOL, MOL2, CML, InChI, SMILES, and PDB"/>
     </xml>
 
+    <xml name="infile_all_types_except_inchi">
+        <param name="infile" format="sdf,mol,mol2,cml,smi,pdb" type="data" label="Molecular input file"
+        help="Valid file types are: SDF, MOL, MOL2, CML, SMILES, and PDB"/>
+    </xml>
+
     <xml name="2D_3D_opts">
         <param name="gen2d" type="boolean" truevalue="--gen2d" falsevalue="" checked="false"
             label="Generate 2D coordinates" help="(--gen2d)" />