Mercurial > repos > bgruening > chemfp
diff sdf2fps.xml @ 11:92c7cdc243e8 draft
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/chemfp commit 70d32dc05d264ffbe03b0c62e54acd5e904c9b7e-dirty"
author | bgruening |
---|---|
date | Wed, 24 Jun 2020 13:12:05 -0400 |
parents | 0d88631bb7de |
children | 3b14765c22ee |
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--- a/sdf2fps.xml Fri Oct 18 04:57:52 2019 -0400 +++ b/sdf2fps.xml Wed Jun 24 13:12:05 2020 -0400 @@ -1,9 +1,8 @@ -<tool id="ctb_sdf2fps" name="SDF to Fingerprint" version="1.5"> +<tool id="ctb_sdf2fps" name="SDF to Fingerprint" version="1.6"> <description>- extract fingerprints from sdf file metadata</description> <!--parallelism method="multi" split_inputs="infile" split_mode="to_size" split_size="10000" shared_inputs="" merge_outputs="outfile"></parallelism--> <requirements> - <requirement type="package" version="1.5">chemfp</requirement> - <requirement type="package" version="2.4.1">openbabel</requirement> + <requirement type="package" version="1.6">chemfp</requirement> </requirements> <command> <![CDATA[