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OpenFreeEnergy / IndustryBenchmarks2024

Repository for the 2024 OpenFE industry benchmark efforts
https://industrybenchmarks2024.readthedocs.io/en/latest/
MIT License
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QA instructions for the quickrun call script #61

Closed IAlibay closed 2 weeks ago

IAlibay commented 3 weeks ago

We need to QA the instructions for the simulation execution script, making sure we don't overwrite anything.