scikit-chem
0.0.6
Site
An introduction to scikit-chem
What’s New
Quickstart
Installation and Getting Started
Tutorial
API
Developing
Page
API
« Data
skchem package »
Source
API
ΒΆ
The API documentation, autogenerated from the docstrings.
skchem package
Subpackages
skchem.core package
Submodules
skchem.core.atom module
skchem.core.base module
skchem.core.bond module
skchem.core.conformer module
skchem.core.mol module
skchem.core.point module
Module contents
skchem.cross_validation package
Submodules
skchem.cross_validation.similarity_threshold module
Module contents
skchem.data package
Subpackages
Module contents
skchem.descriptors package
Submodules
skchem.descriptors.atom module
skchem.descriptors.chemaxon module
skchem.descriptors.fingerprints module
skchem.descriptors.moe module
skchem.descriptors.physicochemical module
Module contents
skchem.filters package
Submodules
skchem.filters.base module
skchem.filters.simple module
skchem.filters.smarts module
skchem.filters.stereo module
Module contents
skchem.forcefields package
Submodules
skchem.forcefields.base module
skchem.forcefields.mmff module
skchem.forcefields.uff module
Module contents
skchem.interact package
Submodules
skchem.interact.desc_vis module
Module contents
skchem.io package
Submodules
skchem.io.sdf module
skchem.io.smiles module
Module contents
skchem.pandas_ext package
Submodules
skchem.pandas_ext.structure_methods module
Module contents
skchem.pipeline package
Submodules
skchem.pipeline.pipeline module
Module contents
skchem.resource package
Module contents
skchem.standardizers package
Submodules
skchem.standardizers.chemaxon module
Module contents
skchem.test package
Subpackages
Submodules
skchem.test.test_featurizers module
Module contents
skchem.utils package
Submodules
skchem.utils.decorators module
skchem.utils.helpers module
skchem.utils.io module
skchem.utils.progress module
skchem.utils.string module
skchem.utils.suppress module
Module contents
skchem.vis package
Submodules
skchem.vis.atom module
skchem.vis.mol module
Module contents
Submodules
skchem.base module
skchem.metrics module
Module contents