IPKM/mdevaluate
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Fixed spelling

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This commit is contained in:
Sebastian Kloth 2024-01-16 13:37:49 +01:00
parent 5d16c7de5e
commit 9200d31af6
1 changed files with 2 additions and 2 deletions
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4
src/mdevaluate/pbc.py
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@ -153,7 +153,7 @@ def nojump(frame: CoordinateFrame, usecache: bool = True) -> CoordinateFrame:
delta delta
+ np.array( + np.array(
np.vstack( np.vstack(
[m[i0 : abstep + 1].sum(axis=0) for m in reader.nojump_matrixes] [m[i0 : abstep + 1].sum(axis=0) for m in reader.nojump_matrices]
).T ).T
) )
* frame.box.diagonal() * frame.box.diagonal()
@ -169,7 +169,7 @@ def nojump(frame: CoordinateFrame, usecache: bool = True) -> CoordinateFrame:
np.vstack( np.vstack(
[ [
m[: frame.step + 1, selection].sum(axis=0) m[: frame.step + 1, selection].sum(axis=0)
for m in reader.nojump_matrixes for m in reader.nojump_matrices
] ]
).T ).T
) )