Switch to using LAMMPS GPU Package - Githubissues

globus-labs / mof-generation-at-scale

Create new MOFs by combining generative AI and simulation on HPC

MIT License

18 stars 5 forks source link

Switch to using LAMMPS GPU Package #56

Closed WardLT closed 8 months ago

WardLT commented 8 months ago

Better performance on our problem type

coveralls commented 8 months ago

Pull Request Test Coverage Report for Build 8302597275

Details

1 of 1 (100.0%) changed or added relevant line in 1 file are covered.
No unchanged relevant lines lost coverage.
Overall coverage remained the same at 41.215%

Totals
Change from base Build 8284471488:	0.0%
Covered Lines:	4063
Relevant Lines:	9858

💛 - Coveralls