Mercurial > repos > recetox > rem_complex
view macros.xml @ 1:e0ca9dfcdb18 draft
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/rem_complex commit ad718c989f31829edc89e039e56644a95dab6791
author | recetox |
---|---|
date | Fri, 01 Dec 2023 10:24:50 +0000 |
parents | a0e07a0bc047 |
children |
line wrap: on
line source
<macros> <token name="@TOOL_VERSION@">1.0.0</token> <xml name="creator"> <creator> <person givenName="Wudmir" familyName="Rojas" url="https://github.com/wverastegui" identifier="0000-0001-7036-9987" /> <person givenName="Helge" familyName="Hecht" url="https://github.com/hechth" identifier="0000-0001-6744-996X" /> <organization url="https://www.recetox.muni.cz/" email="GalaxyToolsDevelopmentandDeployment@space.muni.cz" name="RECETOX MUNI"/> </creator> </xml> <token name="@HELP@"><![CDATA[ The remove complex tool filters out coordination complexes from a list of SMLES or InChI. Documentation The rem complex tool removes coordination complexes from a list of SMLES or InChI. The tool accepts input files with csv, smi and inchi formats, and returns the same format as the input file. The tool is based on the openbabel python library. ]]> </token> </macros>