Fix MD autorestart

ElliottKasoar · Feb 24, 2025 · a4a3efe · a4a3efe
1 parent 848bf51
commit a4a3efe
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/janus_core/calculations/md.py b/janus_core/calculations/md.py
@@ -555,7 +555,7 @@ def _prepare_restart(self) -> None:
                 last_restart = max(poss_restarts, key=getmtime)
 
                 # Read in last structure
-                self.struct = input_structs(
+                self.struct, self.struct_path = input_structs(
                     struct=last_restart,
                     read_kwargs=self.read_kwargs,
                     sequence_allowed=False,