ISISNeutronMuon / ISISNeutronMuon/MDMC
Add system test for LAMMPS trajectory conversion
Open
P1
testing
- Dominant language
- Python
- Stars
- 4
- Forks
- 0
- Avg merge
- 2d 4h
- Merged PRs (30d)
- 5
Description
Add a system test for converting between a LAMMPS trajectory file and an MDMC Trajectory object. This should use a single water molecule for a small number of steps, so that the position of each atom at each step can be hard coded into the test.
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