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globus-labs / faster-molecular-hessians / 7130394642 / 1
97%
main: 97%

Build:
DEFAULT BRANCH: main
Ran 07 Dec 2023 03:35PM UTC
Files 15
Run time 0s
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07 Dec 2023 03:33PM UTC coverage: 97.19% (+0.02%) from 97.173%
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Add ability to deploy on HPC (#31)

* Send whole atoms record back

* Run ASE inside a temporary directory

Avoid calcualtions from intefering with each other

* Test with >1 worker

* Add option for loading parsl configuration

* Name the run directory based on hessian method

* Test the parsl config loader

588 of 605 relevant lines covered (97.19%)

0.97 hits per line

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