lobsterpy.featurize

This package provides the modules for featurzing Lobster data ready for ML studies.

Modules

lobsterpy.featurize.batch	This module defines wrapper classes to quickly obtain similarity matrix of input fingerprint objects.
lobsterpy.featurize.core	This module defines classes to featurize Lobster data ready to be used for ML studies.
lobsterpy.featurize.utils	This package provides the modules for featurzing Lobster data ready for ML studies.