diff --git a/devtools/conda-envs/alchemiscale-client.yml b/devtools/conda-envs/alchemiscale-client.yml index c3abc819..163f4c65 100644 --- a/devtools/conda-envs/alchemiscale-client.yml +++ b/devtools/conda-envs/alchemiscale-client.yml @@ -5,11 +5,12 @@ channels: - openeye dependencies: - pip - - python =3.11 + - python =3.10 # alchemiscale dependencies - gufe=0.9.4 - openfe=0.13.0 + - openmmforcefields>=0.12.0 - requests - click - httpx diff --git a/devtools/conda-envs/alchemiscale-compute.yml b/devtools/conda-envs/alchemiscale-compute.yml index d24f4e1c..a9d2cb7a 100644 --- a/devtools/conda-envs/alchemiscale-compute.yml +++ b/devtools/conda-envs/alchemiscale-compute.yml @@ -4,12 +4,13 @@ channels: - openeye dependencies: - pip - - python =3.11 + - python =3.10 - cudatoolkit <=11.7 # many actual compute resources are not yet compatible with cudatoolkit >=11.8 # alchemiscale dependencies - gufe=0.9.4 - openfe=0.13.0 + - openmmforcefields>=0.12.0 - requests - click - httpx diff --git a/devtools/conda-envs/alchemiscale-server.yml b/devtools/conda-envs/alchemiscale-server.yml index b0bd1534..b0da31bb 100644 --- a/devtools/conda-envs/alchemiscale-server.yml +++ b/devtools/conda-envs/alchemiscale-server.yml @@ -5,11 +5,12 @@ channels: - openeye dependencies: - pip - - python =3.11 + - python =3.10 # alchemiscale dependencies - gufe=0.9.4 - openfe=0.13.0 + - openmmforcefields>=0.12.0 - requests - click - pydantic<2.0 diff --git a/devtools/conda-envs/test.yml b/devtools/conda-envs/test.yml index 8d09243e..5bd0257f 100644 --- a/devtools/conda-envs/test.yml +++ b/devtools/conda-envs/test.yml @@ -55,7 +55,7 @@ dependencies: # needed for openfe-benchmark tests - lomap2>=2.1.0 - openmmtools - - openmmforcefields + - openmmforcefields>=0.12.0 - pip: - async_lru