diff --git a/devtools/conda-envs/dev_env.yaml b/devtools/conda-envs/dev_env.yaml index 3a4b2f5..364874b 100644 --- a/devtools/conda-envs/dev_env.yaml +++ b/devtools/conda-envs/dev_env.yaml @@ -17,6 +17,7 @@ dependencies: - scipy - ipython - pymbar<4 + - alchemlyb=1.0.1 - ambertools - biosimspace>2023.4 - numpydoc @@ -36,4 +37,3 @@ dependencies: # Development tools - pre-commit -