Descriptors: shape - Githubissues

lewisacidic / scikit-chem

A high level cheminformatics package for the Scientific Python stack, built on RDKit.

http://scikit-chem.readthedocs.io/en/latest/index.html

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Descriptors: shape #71

Open lewisacidic opened 8 years ago

lewisacidic commented 8 years ago

[ ] kier hall molecular flexibility
[ ] kappa1
[ ] kappa2
[ ] kappa3
[ ] kappa1a
[ ] kappa2a
[ ] kappa3a

For all:

[ ] implementation
[ ] mathematical formulation
[ ] example usage
[ ] reference
[ ] extensive tests