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luigibonati / mlcolvar

A unified framework for machine learning collective variables for enhanced sampling simulations
MIT License
89 stars 24 forks source link

Merge lightning into main #55

Closed luigibonati closed 1 year ago

luigibonati commented 1 year ago

Description

I created a tag/release with the bugfix on main (v0.2.2) and created a pre-lightning branch for convenience. Now I will merge the lightning branch into main to prepare for the new release.

luigibonati commented 1 year ago

(besides #54 that makes the tests fail, we should be ready to go)