# HG changeset patch
# User iuc
# Date 1742455436 0
# Node ID 8d1e0ca750aa5f130043b0f97bbef39ff2dbac88
# Parent 46d4ac243530c1fdba3c6cf18522ac1a86ac29c6
planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/master/tools/rrparser commit 83279dc554c34566720f3857ac914a2e4fd85a8d
diff -r 46d4ac243530 -r 8d1e0ca750aa rrparser.xml
--- a/rrparser.xml Thu Apr 13 07:26:39 2023 +0000
+++ b/rrparser.xml Thu Mar 20 07:23:56 2025 +0000
@@ -2,7 +2,7 @@
Retrieve the reaction rules from RetroRules0
- 2.5.2
+ 2.6.0rrparser
@@ -38,6 +38,9 @@
+
+
+
@@ -90,7 +93,7 @@
Retrieve the reaction rules from `RetroRules `_ extracted from public databases and expressed in the community-standard SMARTS (SMILES arbitrary target specification) format, augmented by a rule representation at different levels of specificity (the atomic environment around the reaction center).
-The generated output is a file containing reaction rules which are generic descriptions of chemical reactions that can be used in retrosynthesis workflows (e.g. `Retrosynthesis KNIME Workflow `_) in order to enumerate all possible biosynthetic routes connecting a target molecule to its precursors.
+The generated output is a file containing reaction rules which are generic descriptions of chemical reactions that can be used in retrosynthesis workflows (e.g. Retrosynthesis KNIME Workflow) in order to enumerate all possible biosynthetic routes connecting a target molecule to its precursors.
Input
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@@ -108,7 +111,7 @@
Version
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-v2.5.0
+v2.6.0
Authors
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