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AstraZeneca / kallisto

Efficiently calculate 3D-features for quantitative structure-activity relationship approaches.
https://ehjc.gitbook.io/kallisto/
Apache License 2.0
61 stars 21 forks source link

Packaging for PyPI or conda? #2

Closed awvwgk closed 3 years ago

awvwgk commented 3 years ago

The current toolchain to install this project is quite heavy on the user. Is there a plan to provide packaged versions of this project on a conda channel or via PyPI?

f3rmion commented 3 years ago

The current toolchain to install this project is quite heavy on the user. Is there a plan to provide packaged versions of this project on a conda channel or via PyPI?

Yes indeed, there will be a PyPi package soon, which will simplify the installation process.