digichem-core 7.0.3__tar.gz → 7.0.4__tar.gz

{digichem_core-7.0.3 → digichem_core-7.0.4}/PKG-INFO

@@ -1,6 +1,6 @@
 Metadata-Version: 2.4
 Name: digichem-core
-Version: 7.0.3
+Version: 7.0.4
 Summary: Open-source library for Digichem core components
 Project-URL: Homepage, https://github.com/Digichem-Project/digichem-core
 Project-URL: Documentation, https://doc.digi-chem.co.uk

{digichem_core-7.0.3 → digichem_core-7.0.4}/digichem/__init__.py

@@ -20,7 +20,7 @@ from digichem.datas import get_resource
 # development = prerelease is not None
 # # The full version number of this package.
 # __version__ = "{}.{}.{}{}".format(major_version, minor_version, revision, "-pre.{}".format(prerelease) if development else "")
-__version__ = "7.0.3"
+__version__ = "7.0.4"
 _v_parts = __version__.split("-")[0].split(".")
 major_version = int(_v_parts[0])
 minor_version = int(_v_parts[1])
@@ -39,7 +39,7 @@ __author__ = [
 ]
 
 # Program date (when we were last updated). This is changed automatically.
-_last_updated_string = "13/11/2025"
+_last_updated_string = "18/11/2025"
 last_updated = datetime.strptime(_last_updated_string, "%d/%m/%Y")
 
 # The sys attribute 'frozen' is our flag, '_MEIPASS' is the dir location.

{digichem_core-7.0.3 → digichem_core-7.0.4}/digichem/result/excited_state.py

@@ -386,12 +386,12 @@ class Excited_state_transition(Result_object):
         }
         
     @classmethod
-    def list_from_parser(self, parser, threshold = 1e-4):
+    def list_from_parser(self, parser, threshold = 1e-3):
         """
         Create a list of excited state transitions from an output file parser.
         
         :param parser: An output file parser.
-        :param threshold: The threshold below which transitions will be discarded.
+        :param threshold: The probability threshold below which transitions will be discarded.
         :return: A list of Excited_state_transition objects.
         """
         try: