From 28f2d7b71758ac6ceca4cfb555d390e22bb4034a Mon Sep 17 00:00:00 2001 From: Paul Saxe Date: Thu, 21 Mar 2024 09:51:53 -0400 Subject: [PATCH] Moving pymbar to pip from conda to see if that fixes version issues. --- devtools/conda-envs/test_env.yaml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/devtools/conda-envs/test_env.yaml b/devtools/conda-envs/test_env.yaml index 6092d47..380234d 100644 --- a/devtools/conda-envs/test_env.yaml +++ b/devtools/conda-envs/test_env.yaml @@ -11,7 +11,6 @@ dependencies: # SEAMM - kim-query - - pymbar>=4.0 - seamm - seamm-ff-util - statsmodels @@ -30,6 +29,7 @@ dependencies: # Pip-only installs - pip: + - pymbar>=4.0 - seamm-exec # Documentation - sphinx-copybutton