globus-labs / mof-generation-at-scale

Create new MOFs by combining generative AI and simulation on HPC
MIT License
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Port Colmena application to Polaris #52

Closed WardLT closed 9 months ago

WardLT commented 9 months ago

Make the compute resources configurable, add jobscript for Polaris, add utilization monitoring.

Fixes #33

coveralls commented 9 months ago

Pull Request Test Coverage Report for Build 8114672857

Warning: This coverage report may be inaccurate.

This pull request's base commit is no longer the HEAD commit of its target branch. This means it includes changes from outside the original pull request, including, potentially, unrelated coverage changes.

Details


Changes Missing Coverage Covered Lines Changed/Added Lines %
mofa/hpc/config.py 45 50 90.0%
mofa/hpc/utilization.py 26 43 60.47%
<!-- Total: 71 93 76.34% -->
Totals Coverage Status
Change from base Build 8096740723: 0.6%
Covered Lines: 4089
Relevant Lines: 9858

💛 - Coveralls