choderalab / software-development

A primer on software development best practices for computational chemistry
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Packaging #4

Closed jchodera closed 7 years ago

jchodera commented 7 years ago

omnia uses the conda packaging system to easily deploy packages and dependencies. We have a build infrastructure built around this, but conda-forge may be a better way to go in the long term.

Pure python can also readily be packaged via PyPI, and the Python wheel may eventually eliminate the need for conda.

jchodera commented 7 years ago

Addressed in #20 and #28