Fix checkpoint name (#594)

* Fix checkpoint name * also fix for AFEs
OpenFreeEnergy · Oct 31, 2023 · 6bf481b · 6bf481b
1 parent 2b762c6
commit 6bf481b
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Showing 2 changed files with 2 additions and 2 deletions.
diff --git a/openfe/protocols/openmm_afe/base.py b/openfe/protocols/openmm_afe/base.py
@@ -564,7 +564,7 @@ def _get_reporter(
         )
 
         nc = self.shared_basepath / simulation_settings.output_filename
-        chk = self.shared_basepath / simulation_settings.checkpoint_storage
+        chk = simulation_settings.checkpoint_storage
 
         reporter = multistate.MultiStateReporter(
             storage=nc,

diff --git a/openfe/protocols/openmm_rfe/equil_rfe_methods.py b/openfe/protocols/openmm_rfe/equil_rfe_methods.py
@@ -666,7 +666,7 @@ def run(self, *, dry=False, verbose=True,
 
         #  a. Create the multistate reporter
         nc = shared_basepath / sim_settings.output_filename
-        chk = shared_basepath / sim_settings.checkpoint_storage
+        chk = sim_settings.checkpoint_storage
         reporter = multistate.MultiStateReporter(
             storage=nc,
             analysis_particle_indices=selection_indices,