From 88f7f3f77c322828f384973bc05515abcbcc9755 Mon Sep 17 00:00:00 2001 From: Olivier Date: Thu, 19 Oct 2023 10:37:31 +0200 Subject: [PATCH] Update test_internal_pca.sh --- tests/test_internal_pca.sh | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tests/test_internal_pca.sh b/tests/test_internal_pca.sh index 99898b8..83534c4 100755 --- a/tests/test_internal_pca.sh +++ b/tests/test_internal_pca.sh @@ -1,5 +1,5 @@ #!/bin/bash -cd .. +cd ../src ./internal_pca.py --trj tests/pca_test_trj.xtc --top tests/complex.pdb