From 1187ff2ed2c8dd6848c603c1ee4dbbe44de694e3 Mon Sep 17 00:00:00 2001 From: loeflerm Date: Thu, 22 Aug 2024 13:36:18 +0200 Subject: [PATCH] added multiple runs option for energies submit script --- transformato/state.py | 1 + 1 file changed, 1 insertion(+) diff --git a/transformato/state.py b/transformato/state.py index 4a6c3f29..e3923698 100644 --- a/transformato/state.py +++ b/transformato/state.py @@ -525,6 +525,7 @@ def _copy_omm_files(self, intermediate_state_file_path: str): if self.multiple_runs: self._modify_submit_script(omm_simulation_submit_script_target) + self._modify_submit_script(omm_init_energies_submit_script_target) # Prepend workload manager instructions self._write_workload_preamble(omm_simulation_submit_script_target)