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cmelab / grits

A toolkit for working with coarse-grain systems
https://grits.readthedocs.io
GNU General Public License v3.0
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Add docker builder #77

Closed jennyfothergill closed 6 months ago

jennyfothergill commented 6 months ago

shoutout to @mikemhenry and using https://github.com/OpenFreeEnergy/openfe/blob/main/.github/workflows/docker.yaml as example