format opttimizgeometries.py (#107)

* format opttimizgeometries.py

* downgrade version of Sphinx to 8.1.3 to avoid incompatlbe

Author: xiangchenjhu

bluephos/tasks/optimizegeometries.py

@@ -89,7 +89,7 @@ def optimize(row, xtb, isomer):
                 return row  # Return the updated row
 
         except InputError:
-            logger.error(f"InputError for {mol_id}, will attempt {3 - (attempt+1)} more times")
+            logger.error(f"InputError for {mol_id}, will attempt {3 - (attempt + 1)} more times")
             sleep(10)
             continue
         except ValueError:

requirements/docs.txt

@@ -1,6 +1,6 @@
 -r dev.txt
 
-sphinx==8.2.3
+sphinx==8.1.3
 sphinx_rtd_theme==3.0.2
 sphinx_book_theme==1.1.4
 sphinx-automodapi==0.18.0