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re-execute nbs to update numpy types
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-144
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6 files changed

+435
-144
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doc/source/examples/analysis/alignment_and_rms/aligning_structure_to_another.ipynb

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"name": "stdout",
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"output_type": "stream",
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"text": [
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"(21.712154435976014, 6.817293751703919)\n"
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"(np.float64(21.712154435976014), 6.817293751703919)\n"
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]
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}
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],
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"name": "stdout",
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"output_type": "stream",
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"text": [
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"(18.991465038265208, 16.603704620787127)\n"
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"(np.float64(18.991465038265208), 16.603704620787127)\n"
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]
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}
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],
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"metadata": {
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"celltoolbar": "Raw Cell Format",
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"kernelspec": {
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"display_name": "Python 3.9.15 ('mda-user-guide')",
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"display_name": "Python 3 (ipykernel)",
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"language": "python",
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"name": "python3"
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},
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"name": "python",
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"nbconvert_exporter": "python",
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"pygments_lexer": "ipython3",
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"version": "3.9.15"
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"version": "3.10.16"
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},
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"toc": {
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"base_numbering": 1,

doc/source/examples/analysis/polymers_and_membranes/hole2.ipynb

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doc/source/examples/analysis/structure/dihedrals.ipynb

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doc/source/examples/analysis/structure/site_specific_rdf.ipynb

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doc/source/examples/analysis/trajectory_similarity/harmonic_ensemble_similarity.ipynb

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"shell.execute_reply": "2021-05-19T06:01:12.662787Z"
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}
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},
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"outputs": [],
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"outputs": [
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{
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"name": "stderr",
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"output_type": "stream",
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"text": [
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"/Users/lily/micromamba/envs/mda-user-guide-dev/lib/python3.10/site-packages/MDAnalysis/analysis/encore/__init__.py:45: DeprecationWarning: Deprecation in version 2.8.0\n",
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"MDAnalysis.analysis.encore is deprecated in favour of the MDAKit mdaencore (https://www.mdanalysis.org/mdaencore/) and will be removed in MDAnalysis version 3.0.0.\n",
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" warnings.warn(wmsg, category=DeprecationWarning)\n"
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]
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}
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],
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"source": [
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"import numpy as np\n",
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"import matplotlib.pyplot as plt\n",
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"name": "stderr",
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"output_type": "stream",
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"text": [
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"/home/pbarletta/mambaforge/envs/mda-user-guide/lib/python3.9/site-packages/MDAnalysis/coordinates/DCD.py:165: DeprecationWarning: DCDReader currently makes independent timesteps by copying self.ts while other readers update self.ts inplace. This behaviour will be changed in 3.0 to be the same as other readers\n",
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"/Users/lily/micromamba/envs/mda-user-guide-dev/lib/python3.10/site-packages/MDAnalysis/coordinates/DCD.py:165: DeprecationWarning: DCDReader currently makes independent timesteps by copying self.ts while other readers update self.ts inplace. This behavior will be changed in 3.0 to be the same as other readers. Read more at https://github.com/MDAnalysis/mdanalysis/issues/3889 to learn if this change in behavior might affect you.\n",
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" warnings.warn(\"DCDReader currently makes independent timesteps\"\n"
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]
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}
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],
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"metadata": {
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"kernelspec": {
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"display_name": "Python 3.9.15 ('mda-user-guide')",
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"display_name": "Python 3 (ipykernel)",
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"language": "python",
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"name": "python3"
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},
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"name": "python",
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"nbconvert_exporter": "python",
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"pygments_lexer": "ipython3",
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"version": "3.9.15"
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"version": "3.10.16"
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},
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"toc": {
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"base_numbering": 1,

doc/source/examples/analysis/volumetric/linear_density.ipynb

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