OpenFreeEnergy / gufe

grand unified free energy by OpenFE
https://gufe.readthedocs.io
MIT License
28 stars 8 forks source link

Bump up default openforcefield version to 2.1 #303

Closed IAlibay closed 5 months ago

IAlibay commented 5 months ago

@hannahbaumann has been benchmarking things with 2.1, we should be using it instead.