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Regenerate MSK grid (#159)
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mattwthompson committed Jan 24, 2024
1 parent 9b802c6 commit c44d767
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2 changes: 1 addition & 1 deletion devtools/conda-envs/test_env_rdkit_and_openeye.yaml
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Expand Up @@ -23,7 +23,7 @@ dependencies:
- sqlite

### Optional dependencies.
- openeye-toolkits
- openeye-toolkits =2023.2
- rdkit

# ESP calculations
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