use imd-v3-integration as ref for LAMMPS fork

Becksteinlab / imdclient

Streaming analysis from running MD simulations.

https://imdclient.readthedocs.io/

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Closed orbeckst closed 5 days ago

orbeckst commented 5 days ago

Fixes #39

Changes made in this Pull Request:

orbeckst commented 5 days ago

Fixed the LAMMPS integration workflow.

ljwoods2 commented 5 days ago

Will steal this change for the "docker" branch where I am rewriting the tests using docker instead of building in the CI