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diff mol2fps.xml @ 42:0a1c281e9224 draft default tip

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/chemfp commit 7fb96a3844b4771084f18de2346ed6d5e241d839"
author bgruening
date Sat, 25 Sep 2021 19:05:59 +0000
parents 02e03ac072cf
children
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--- a/mol2fps.xml	Fri Oct 18 04:57:12 2019 -0400
+++ b/mol2fps.xml	Sat Sep 25 19:05:59 2021 +0000
@@ -1,11 +1,13 @@
-<tool id="ctb_chemfp_mol2fps" name="Molecule to fingerprint" version="1.5">
+<tool id="ctb_chemfp_mol2fps" name="Molecule to fingerprint" version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@">
     <description>conversion to several different fingerprint formats</description>
     <!--parallelism method="multi" split_inputs="infile" split_mode="to_size" split_size="10000" merge_outputs="outfile"></parallelism-->
     <requirements>
-        <requirement type="package" version="1.5">chemfp</requirement>
-        <requirement type="package" version="2018.09.3">rdkit</requirement>
-        <requirement type="package" version="2.4.1">openbabel</requirement>
+        <requirement type="package" version="@TOOL_VERSION@">chemfp</requirement>
     </requirements>
+    <macros>
+        <token name="@TOOL_VERSION@">1.6.1</token>
+        <token name="@VERSION_SUFFIX@">0</token>
+    </macros>
     <command>
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