Merge pull request #166 from molssi-seamm/dev

Adding time to Results.json

HISTORY.rst

@@ -1,6 +1,10 @@
 =======
 History
 =======
+2024.5.3 -- Added the time to Results.json
+    * Adding time into the Results.json file will allow ensuring that the most
+      recent data is used, when there are duplicates.
+
 2024.5.1 -- Added ability to store results in Results.json file
     * Added column in the results tab for saving results to JSON
     * Added separators between the columns of the results table to make clearer which

seamm/node.py

@@ -6,7 +6,7 @@
 import bibtexparser
 import calendar
 import collections.abc
-from datetime import datetime
+from datetime import datetime, timezone
 import hashlib
 
 try:
@@ -1257,6 +1257,8 @@ def store_results(
 
         # Save the data as JSON
         if len(json_data) > 0:
+            # Add a timestamp
+            json_data["iso time"] = datetime.now(timezone.utc).isoformat()
             path = Path(self.directory) / "Results.json"
             with path.open("w") as fd:
                 json.dump(