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Modified environment to pick chemiscope from gh
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ceriottm committed Oct 20, 2023
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5 changes: 2 additions & 3 deletions examples/roy_gch/environement.yml
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name: lode_linear
name: roy_gch
dependencies:
- python=3.11
- pip
- pip:
- ase
- chemiscope
- chemiscope @ git+https://github.com/lab-cosmo/chemiscope
- skmatter
- metatensor
- equisolve @ git+https://github.com/lab-cosmo/equisolve.git@63c9c54046507b27f115efb1d9b9fa8a1573c4da
- rascaline @ git+https://github.com/Luthaf/rascaline@581d0ca4dece424b4594c8c3cac40a7381e13ae5

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