From fdab36501ce532e1d18e4533663b88cb93cd8c89 Mon Sep 17 00:00:00 2001 From: Yuman Hordijk Date: Sun, 16 Jun 2024 19:18:08 +0200 Subject: [PATCH] removed the second .in --- src/tcutility/job/orca.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/tcutility/job/orca.py b/src/tcutility/job/orca.py index 0e5f99a7..a80a725f 100644 --- a/src/tcutility/job/orca.py +++ b/src/tcutility/job/orca.py @@ -215,7 +215,7 @@ def _setup_job(self): runf.write('rm -rf $TMPDIR\n') else: - runf.write(f'{self.orca_path} {self.inputfile_path}.in\n') + runf.write(f'{self.orca_path} {self.inputfile_path}\n') runf.write('\n'.join(self._postambles))