Mercurial > repos > bgruening > openbabel

diff modify/remove_protonation_state.xml @ 16:3d3e7c1d0f49

Find changesets by keywords (author, files, the commit message), revision number or hash, or revset expression.
ChemicalToolBoX update.
author Bjoern Gruening <bjoern.gruening@gmail.com>
date Fri, 19 Jul 2013 16:27:52 +0200
parents ec87a42dccec
children
line wrap: on
line diff
--- a/modify/remove_protonation_state.xml	Sat Jun 01 20:02:50 2013 +0200
+++ b/modify/remove_protonation_state.xml	Fri Jul 19 16:27:52 2013 +0200
@@ -23,11 +23,21 @@
     </tests>
     <help>
 
+.. class:: infomark
 
-**What it does**
-Remove protonation state of every atom.
+**What this tool does**
+
+Removes the protonation state of every atom.
 
 -----
 
+.. class:: infomark
+
+**Cite**
+
+`Open Babel`_
+
+.. _Open Babel: http://openbabel.org/wiki/Main_Page
+
     </help>
 </tool>