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remove unused files
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Yury Lysogorskiy committed Nov 21, 2024
1 parent 1af997a commit 35b872e
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Showing 2 changed files with 0 additions and 9 deletions.
Binary file removed tests/data/HME21_test_clean_small.pkl.gz
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9 changes: 0 additions & 9 deletions tests/test_process_df.py
Original file line number Diff line number Diff line change
Expand Up @@ -31,12 +31,3 @@ def test_compute_convex_hull():

assert np.allclose(echmin, 0.0)
assert np.allclose(echmax, 0.435098487307693)


# def test_compute_convex_hull_HME21():
# fname = str(prefix / "data" / "HME21_test_clean_small.pkl.gz")
# df = pd.read_pickle(fname)
# df["energy_per_atom"] = df["energy"] / df["NUMBER_OF_ATOMS"]
# assert E_CHULL_DIST_PER_ATOM not in df.columns
# with pytest.raises(RuntimeError):
# compute_convexhull_dist(df, verbose=True)

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