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T020: openmm warning #356

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mbackenkoehler opened this issue May 15, 2023 · 2 comments
Open

T020: openmm warning #356

mbackenkoehler opened this issue May 15, 2023 · 2 comments

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@mbackenkoehler
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On the third code cell, the following warning appears

Warning: importing 'simtk.openmm' is deprecated.  Import 'openmm' instead.
/home/michael/.miniconda3/envs/teachopencadd/lib/python3.9/site-packages/MDAnalysis/coordinates/XDR.py:237: UserWarning: Reload offsets from trajectory
 ctime or size or n_atoms did not match
  warnings.warn("Reload offsets from trajectory\n "
@AndreaVolkamer
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I think this was addressed in T019 also at some point (PR #308). @dominiquesydow ?

@dominiquesydow
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Yes, I think this should have been addressed --- did you still see this issue after merging that PR?

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@dominiquesydow @mbackenkoehler @AndreaVolkamer