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update PathSimAnalysis install command #166

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Sep 20, 2024
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2 changes: 1 addition & 1 deletion mdakits/pathsimanalysis/metadata.yaml
Original file line number Diff line number Diff line change
Expand Up @@ -20,7 +20,7 @@ documentation_home: https://mdanalysis.org/PathSimAnalysis
documentation_type: API

install:
- pip install pathsimanalysis
- mamba install -c conda-forge pathsimanalysis
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(non-blocking) are we happy to just assume that people will have mamba installed? Or is conda safer?

Otherwise LGTM!

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We use this line ourselves for the workflow so I think this is fine, apart from the fact that it seems a good idea to promote mamba in the eco system.


src_install:
- pip install git+https://github.com/MDAnalysis/PathSimAnalysis@main
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