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nomad-lab
analytics
Commits
bb559412
Commit
bb559412
authored
2 years ago
by
Adam Fekete
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update dependencies
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93bf1bce
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!121
Draft: Resolve "Refactoring the infrastructure"
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3rdparty/atomic-features-package
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3rdparty/cmlkit
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3rdparty/cmlkit
test.txt
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test.txt
tutorials/analytics-atomic-features
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tutorials/analytics-atomic-features
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pip-compile \
./tutorials/analytics-arise/setup.py \
./tutorials/analytics-atomic-features/setup.py \
./tutorials/analytics-catalysis-MRS2021/setup.py \
./tutorials/analytics-clustering-tutorial/setup.py \
./tutorials/analytics-cmlkit/setup.py \
./tutorials/analytics-co2-sgd-tutorial/setup.py \
./tutorials/analytics-compressed-sensing/setup.py \
./tutorials/analytics-convolutional-nn/setup.py \
./tutorials/analytics-decision-tree/setup.py \
./tutorials/analytics-descriptor-role/setup.py \
./tutorials/analytics-dimensionality-reduction/setup.py \
./tutorials/analytics-domain-of-applicability/setup.py \
./tutorials/analytics-dos-similarity-search/setup.py \
./tutorials/analytics-error-estimates/setup.py \
./tutorials/analytics-exploratory-analysis/setup.py \
./tutorials/analytics-gap-si-surface/setup.py \
./tutorials/analytics-grain-boundaries/setup.py \
./tutorials/analytics-kaggle-competition/setup.py \
./tutorials/analytics-kappa-screening-sisso/setup.py \
./tutorials/analytics-krr4mat/setup.py \
./tutorials/analytics-metalInsulator-PRM2018/setup.py \
./tutorials/analytics-nn-regression/setup.py \
./tutorials/analytics-perovskites-tolerance-factor/setup.py \
./tutorials/analytics-proto-archetype-clustering-sisso/setup.py \
./tutorials/analytics-query-nomad-archive/setup.py \
./tutorials/analytics-sgd-alloys-oxygen-reduction-evolution/setup.py \
./tutorials/analytics-sgd-propylene-oxidation-hte/setup.py \
./tutorials/analytics-soap-atomic-charges/setup.py \
./tutorials/analytics-svm-classification/setup.py \
./tutorials/analytics-tcmi/setup.py \
./tutorials/analytics-tetradymite-PRM2020/setup.py \
--output-file requirements.txt
pip-compile \
./3rdparty/atomic-features-package/setup.py \
./3rdparty/cmlkit/pyproject.toml \
./3rdparty/keras-vis/setup.py \
./3rdparty/pysisso/setup.py \
./3rdparty/sissopp/setup.py
pip-compile ./3rdparty/nomad-FAIR/setup.py
pip-compile ./3rdparty/qmmlpack/
pip-compile ./3rdparty/quip/quippy/setup.py
pip-compile \
./tutorials/analytics-arise/setup.py \
./tutorials/analytics-atomic-features/setup.py \
./tutorials/analytics-catalysis-MRS2021/setup.py \
./tutorials/analytics-clustering-tutorial/setup.py \
./tutorials/analytics-cmlkit/setup.py \
./tutorials/analytics-co2-sgd-tutorial/setup.py \
./tutorials/analytics-compressed-sensing/setup.py \
./tutorials/analytics-convolutional-nn/setup.py \
./tutorials/analytics-decision-tree/setup.py \
./tutorials/analytics-descriptor-role/setup.py \
./tutorials/analytics-dimensionality-reduction/setup.py \
./tutorials/analytics-domain-of-applicability/setup.py \
./tutorials/analytics-dos-similarity-search/setup.py \
./tutorials/analytics-error-estimates/setup.py \
./tutorials/analytics-exploratory-analysis/setup.py \
./tutorials/analytics-gap-si-surface/setup.py \
./tutorials/analytics-grain-boundaries/setup.py \
./tutorials/analytics-kaggle-competition/setup.py \
./tutorials/analytics-kappa-screening-sisso/setup.py \
./tutorials/analytics-krr4mat/setup.py \
./tutorials/analytics-metalInsulator-PRM2018/setup.py \
./tutorials/analytics-nn-regression/setup.py \
./tutorials/analytics-perovskites-tolerance-factor/setup.py \
./tutorials/analytics-proto-archetype-clustering-sisso/setup.py \
./tutorials/analytics-query-nomad-archive/setup.py \
./tutorials/analytics-sgd-alloys-oxygen-reduction-evolution/setup.py \
./tutorials/analytics-sgd-propylene-oxidation-hte/setup.py \
./tutorials/analytics-soap-atomic-charges/setup.py \
./tutorials/analytics-svm-classification/setup.py \
./tutorials/analytics-tcmi/setup.py \
./tutorials/analytics-tetradymite-PRM2020/setup.py \
./3rdparty/atomic-features-package/pyproject.toml \
./3rdparty/cmlkit/pyproject.toml \
./3rdparty/keras-vis/setup.py \
./3rdparty/pysisso/setup.py \
./3rdparty/sissopp/setup.py \
--output-file requirements.txt
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analytics-atomic-features
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