diff macros.xml @ 0:72b687d21f65 draft

"planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/filter_compounds commit 4d2ac914c951166e386a94d8ebb8cb1becfac122"

--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/macros.xml	Tue Mar 22 16:06:54 2022 +0000
@@ -0,0 +1,42 @@
+<macros>
+    <token name="@TOOL_VERSION@">3.1.1</token>
+    <token name="@GALAXY_VERSION@">1</token>
+    <xml name="creator">
+        <creator>
+            <person
+                givenName="Karolína"
+                familyName="Trachtová"
+                url="https://github.com/trachtok" />
+            <organization
+                url="https://www.recetox.muni.cz/"
+                email="[e-mail]"
+                name="RECETOX MUNI" />
+        </creator>
+    </xml>
+
+    <xml name="requirements">
+        <requirements>
+            <requirement type="package" version="@TOOL_VERSION@">openbabel</requirement>
+            <requirement type="package" version="3">python</requirement>
+            <yield />
+        </requirements>
+    </xml>
+
+    <xml name="stdio">
+        <stdio>
+            <exit_code range="1:" level="fatal" description="Error occurred. Please check Tool Standard Error" />
+        </stdio>
+    </xml>
+
+    <token name="@HELP@">
+        <![CDATA[
+            .. class:: infomark
+
+            **What this tool does**
+
+            Filters organometallics (compounds containing atoms other than C|N|O|P|F|S|I|B|Si|Se|Cl|Br|Li|Na|H|K) or
+            anorganics (compounds without C). Input can be either list of SMILES identifiers or indexed table of SMILES
+            (two tab-separated columns, first column is index, second columns is SMILES).
+        ]]>
+    </token>
+</macros>