OpenFreeEnergy / IndustryBenchmarks2024

Repository for the 2024 OpenFE industry benchmark efforts
https://industrybenchmarks2024.readthedocs.io/en/latest/
MIT License
8 stars 18 forks source link

Verify status of single file installer #49

Closed IAlibay closed 3 months ago

IAlibay commented 3 months ago

Related to #46

We should check that the single file installer provides an environment that is equivalent to what we would get from the conda-lock file.