Closed JacksonBurns closed 11 months ago
@JacksonBurns would you like to add that to your current PR ?
I'm not sure, is that the intended solution? If some of the dependencies are not required for testing it would be nice to have a minimal dev package, but I don't know enough about molfeat
to say.
We use conda mainly to manage our environment and dependencies. I will clarify that, but adding alternative through pip is also a good idea.
https://github.com/datamol-io/molfeat/pull/75 should address this issue.
📖 Documentation
To run the tests locally, I had to do a 'full' install, i.e.
pip install -e .[full]
from my cloned repo and manually installpytest
. If this procedure could either be clarified in the contributors document, or a more minimaldev
extras section (that includespytest
) could be added to thepyproject.toml
, that would be helpful.