ss-main: added depedency

Sulstice · Apr 3, 2022 · 35f9ba2 · 35f9ba2
1 parent 3272a25
commit 35f9ba2
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Showing 2 changed files with 2 additions and 2 deletions.
diff --git a/global_chem_extensions/global_chem_extensions/forcefields/gaff2/gaff2_molecule.py b/global_chem_extensions/global_chem_extensions/forcefields/gaff2/gaff2_molecule.py
@@ -14,7 +14,7 @@
 from rdkit.Chem import AllChem
 from rdkit.Chem import GetPeriodicTable
 
-class GAFF2Molecule(object):
+class GaFF2Molecule(object):
 
 
     __version__ = '0.0.1'

diff --git a/global_chem_extensions/setup.py b/global_chem_extensions/setup.py
@@ -36,7 +36,7 @@
 # ----
 setup(
     name="global_chem_extensions",
-    version="0.8.1",
+    version="0.8.3",
     packages=find_packages(),
     license='MPL 2.0',
     author="Suliman Sharif",