diff --git a/envs/environment-cpu.yml b/envs/environment-cpu.yml index d6efa5e5..599fc9a0 100644 --- a/envs/environment-cpu.yml +++ b/envs/environment-cpu.yml @@ -18,7 +18,7 @@ dependencies: # Tools to work with crystalline and molecular data - openbabel==3.1.* - rdkit==2023.03.2 - - pymatgen + - pymatgen==2023.8.10 # Use Conda PyTorch to avoid OpenMP disagreement with other libraries - pytorch==1.13.*