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Add HDF5 support for trajs and model_devis #259

Merged

wanghan-iapcm merged 17 commits into deepmodeling:master from zjgemi:hdf5-trajs

Sep 10, 2024

Merged

Add HDF5 support for trajs and model_devis #259

[pre-commit.ci] auto fixes from pre-commit.com hooks

Codecov / codecov/patch succeeded Sep 6, 2024 in 1s

78.37% of diff hit (within 100.00% threshold of 83.70%)

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78.37% of diff hit (within 100.00% threshold of 83.70%)

Annotations

Check warning on line 63 in dpgen2/exploration/render/traj_render_lammps.py

codecov / codecov/patch

dpgen2/exploration/render/traj_render_lammps.py#L63

Added line #L63 was not covered by tests

Check warning on line 121 in dpgen2/exploration/render/traj_render_lammps.py

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dpgen2/exploration/render/traj_render_lammps.py#L121

Added line #L121 was not covered by tests

Check warning on line 237 in dpgen2/op/run_relax.py

codecov / codecov/patch

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Check warning on line 240 in dpgen2/op/run_relax.py

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