richlewis42 /
scikit-chem
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| 1 |
skchem/forcefields/__init__.py
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| 1 |
skchem/descriptors/__init__.py
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| 3 |
skchem/forcefields/mmff.py
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Configuration
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| 3 |
skchem/forcefields/base.py
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| 3 |
skchem/descriptors/fingerprints.py
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| 4 |
skchem/forcefields/uff.py
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Configuration
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| 12 |
skchem/descriptors/atom.py
Coding Style
Naming
Configuration
Bug
Unused Code
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| 17 |
skchem/filters/smarts.py
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