Simplify the installation #2
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Combine all dependencies in one environment: ``` conda env create -n hippynn -f environment.yml ```
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This is a good direction, thank you. Let's specify minimal version numbers instead of exact.version info hippynn also doesn't require cudatoolkit; pytorch requires it for GPUs but it is an optional dependency of pytorch. Lastly, PR should include update to docs & readme. |
jan-janssen
commented
Feb 8, 2022
| - ase | ||
| - pytorch =*=cuda* | ||
| - numpy | ||
| - matplotlib |
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| - matplotlib |
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Combine all dependencies in one environment: