From dbe3990311caa738012dd25caf70ce2d02e21ae0 Mon Sep 17 00:00:00 2001
From: planemo-autoupdate <planemo-autoupdate@users.noreply.github.com>
Date: Mon, 6 Jan 2025 04:13:38 +0000
Subject: [PATCH] Updating chemicaltoolbox/rdkit from version 2020.03.4 to
 2024.09.4

---
 chemicaltoolbox/rdkit/enumerate_charges.xml | 2 +-
 chemicaltoolbox/rdkit/rdconf.xml            | 2 +-
 chemicaltoolbox/rdkit/rdkit_descriptors.xml | 4 ++--
 chemicaltoolbox/rdkit/sdf_to_tab.xml        | 2 +-
 4 files changed, 5 insertions(+), 5 deletions(-)

diff --git a/chemicaltoolbox/rdkit/enumerate_charges.xml b/chemicaltoolbox/rdkit/enumerate_charges.xml
index bd78697ce4..e5613f5cc6 100644
--- a/chemicaltoolbox/rdkit/enumerate_charges.xml
+++ b/chemicaltoolbox/rdkit/enumerate_charges.xml
@@ -1,7 +1,7 @@
 <tool id="enumerate_charges" name="Enumerate changes" version="@TOOL_VERSION@+galaxy@GALAXY_VERSION@">
     <description>calculated with Dimorphite DL and RDKit</description>
     <macros>
-        <token name="@TOOL_VERSION@">2020.03.4</token>
+        <token name="@TOOL_VERSION@">2024.09.4</token>
         <token name="@GALAXY_VERSION@">0</token>
     </macros>
       <requirements>
diff --git a/chemicaltoolbox/rdkit/rdconf.xml b/chemicaltoolbox/rdkit/rdconf.xml
index 730b8ecf3f..5639cf87fa 100644
--- a/chemicaltoolbox/rdkit/rdconf.xml
+++ b/chemicaltoolbox/rdkit/rdconf.xml
@@ -1,7 +1,7 @@
 <tool id="rdconf" name="RDConf: Low-energy ligand conformer search" version="@TOOL_VERSION@+galaxy@GALAXY_VERSION@">
     <description>using RDKit</description>
     <macros>
-        <token name="@TOOL_VERSION@">2020.03.4</token>
+        <token name="@TOOL_VERSION@">2024.09.4</token>
         <token name="@GALAXY_VERSION@">0</token>
     </macros>
       <requirements>
diff --git a/chemicaltoolbox/rdkit/rdkit_descriptors.xml b/chemicaltoolbox/rdkit/rdkit_descriptors.xml
index 973a0b0ff0..f8f765ed3b 100644
--- a/chemicaltoolbox/rdkit/rdkit_descriptors.xml
+++ b/chemicaltoolbox/rdkit/rdkit_descriptors.xml
@@ -1,8 +1,8 @@
 <tool id="ctb_rdkit_descriptors" name="Descriptors" version="@TOOL_VERSION@+galaxy@GALAXY_VERSION@">
     <description>calculated with RDKit</description>
     <macros>
-        <token name="@TOOL_VERSION@">2020.03.4</token>
-        <token name="@GALAXY_VERSION@">1</token>
+        <token name="@TOOL_VERSION@">2024.09.4</token>
+        <token name="@GALAXY_VERSION@">0</token>
     </macros>
     <!--parallelism method="multi" split_inputs="infile" split_mode="to_size" split_size="10000" shared_inputs="" merge_outputs="outfile"></parallelism-->
     <requirements>
diff --git a/chemicaltoolbox/rdkit/sdf_to_tab.xml b/chemicaltoolbox/rdkit/sdf_to_tab.xml
index b5ad1cfa67..0713810579 100644
--- a/chemicaltoolbox/rdkit/sdf_to_tab.xml
+++ b/chemicaltoolbox/rdkit/sdf_to_tab.xml
@@ -1,6 +1,6 @@
 <tool id="sdf_to_tab" name="Extract values from an SD-file" version="@TOOL_VERSION@+galaxy@GALAXY_VERSION@">
     <macros>
-        <token name="@TOOL_VERSION@">2020.03.4</token>
+        <token name="@TOOL_VERSION@">2024.09.4</token>
         <token name="@GALAXY_VERSION@">0</token>
     </macros>
     <description>into a tabular file using RDKit</description>