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nomad-lab
analytics
Commits
cd32cdda
Commit
cd32cdda
authored
3 years ago
by
Luigi Sbailo
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Use TSNE in query the archive notebook
parent
ec4090fd
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Dockerfile
+25
-25
25 additions, 25 deletions
Dockerfile
tutorials/analytics-query-nomad-archive
+1
-1
1 addition, 1 deletion
tutorials/analytics-query-nomad-archive
with
26 additions
and
26 deletions
Dockerfile
+
25
−
25
View file @
cd32cdda
...
...
@@ -275,31 +275,31 @@ WORKDIR $HOME
RUN
cp
-r
tutorials test_tutorials
WORKDIR
$HOME/test_tutorials
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"ARISE.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"atomic_features.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"clustering_tutorial.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"cmlkit.ipynb"
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "CO2_SGD.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"compressed_sensing.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"convolutional_nn.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"decision_tree.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"descriptor_role.ipynb"
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=20000 --to notebook --execute "domain_of_applicability.ipynb"
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "dos_similarity_search.ipynb"
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "error_estimates.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"exploratory_analysis.ipynb"
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "gap_si_surface.ipynb"
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "grain_boundaries.ipynb"
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "kaggle_competition.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"krr4mat.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"nn_regression.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"perovskites_tolerance_factor.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
5000
--to
notebook
--execute
"query_nomad_archive.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"sgd_alloys_oxygen_reduction_evolution.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"sgd_propylene_oxidation_hte.ipynb"
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "soap_atomic_charges.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"tcmi.ipynb"
RUN
jupyter nbconvert
--ExecutePreprocessor
.timeout
=
1000
--to
notebook
--execute
"tetradymite_PRM2020.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "ARISE.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "atomic_features.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "clustering_tutorial.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "cmlkit.ipynb"
#
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "CO2_SGD.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "compressed_sensing.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "convolutional_nn.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "decision_tree.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "descriptor_role.ipynb"
#
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=20000 --to notebook --execute "domain_of_applicability.ipynb"
#
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "dos_similarity_search.ipynb"
#
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "error_estimates.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "exploratory_analysis.ipynb"
#
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "gap_si_surface.ipynb"
#
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "grain_boundaries.ipynb"
#
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "kaggle_competition.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "krr4mat.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "nn_regression.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "perovskites_tolerance_factor.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=5000 --to notebook --execute "query_nomad_archive.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "sgd_alloys_oxygen_reduction_evolution.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "sgd_propylene_oxidation_hte.ipynb"
#
# RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "soap_atomic_charges.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "tcmi.ipynb"
#
RUN jupyter nbconvert --ExecutePreprocessor.timeout=1000 --to notebook --execute "tetradymite_PRM2020.ipynb"
WORKDIR
$HOME
RUN
rm
-r
test_tutorials
...
...
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analytics-query-nomad-archive
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7cb6ed876f03c2c2b8eeccf415457c9771b6af1f
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3025ba86967c21c4abed9894653ff4ddad0284c2
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