Initial removal of PROPKA input

2020-11-17 23:31:24 +00:00
parent 9dfd87a0eb
commit 239c8183c9
11 changed files with 63 additions and 284 deletions
--- a/propka/conformation_container.py
+++ b/propka/conformation_container.py
@@ -25,7 +25,13 @@ RESIDUE_MULTIPLIER = 1000


 class ConformationContainer:
-    """Container for molecular conformations"""
+    """Container for molecular conformations
+
+
+    .. versionchanged:: 3.4.0
+       Removed :meth:`additional_setup_when_reading_input_files` as reading
+       PROPKA inputs is no longer supported.
+    """

    def __init__(self, name='', parameters=None, molecular_container=None):
        """Initialize conformation container.