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CatMOF
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A
.codecov.yml
 1 -
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catmof\sbu_analysis.py
59 1 -
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catmof\text_mining_tools\paper_pickler.py
14 1 -
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catmof\sbu_capping.py
112 1 1
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catmof\sbu_quantum_ml\density_fitting\psi4_df.py
41 1 3
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catmof\screen_by_metal.py
5 1 -
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catmof\sbu_quantum_ml\training\loop.py
6 1 -
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catmof\sbu_quantum_ml\density_fitting\__init__.py
 1 -
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catmof\tests\test_catmof.py
0 1 -
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catmof\featurization.py
17 1 3
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catmof\text_mining_tools\adjusted_article_downloader\articledownloader.py
132 1 29
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catmof\get_stable_mofs.py
15 1 -
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catmof\text_mining_tools\article.py
197 1 23
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devtools\conda-envs\catmof_env.yaml
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catmof\text_mining_tools\title_fetcher.py
10 1 -
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catmof\sbu_quantum_ml\__init__.py
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catmof\sbu_quantum_ml\training\metrics.py
0 1 -
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.github\workflows\CI.yaml
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cli.py
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B
catmof\sbu_quantum_ml\density_fitting\assemble_features.py
20 2 4