diff --git a/environment-dev.yml b/environment-dev.yml index 23b31af98..10d4aa408 100644 --- a/environment-dev.yml +++ b/environment-dev.yml @@ -18,6 +18,7 @@ dependencies: - pytest - garnett>=0.7.1 - openbabel>=3.0.0 + - openff-toolkit-base >=0.11 - openmm - gsd>=2.9 - parmed>=3.4.3 @@ -26,10 +27,10 @@ dependencies: - pycifrw - rdkit>=2021 - requests + - requests-mock - scipy - treelib - codecov - - bump2version - matplotlib - ipywidgets - ele>=0.2.0