AtomHybridization
- model openff.nagl.features.atoms.AtomHybridization[source]
One-hot encodings for the specified atomic orbital hybridization modes.
- Fields:
- field categories: List[HybridizationType] = [<HybridizationType.OTHER: 'other'>, <HybridizationType.SP: 'sp'>, <HybridizationType.SP2: 'sp2'>, <HybridizationType.SP3: 'sp3'>, <HybridizationType.SP3D: 'sp3d'>, <HybridizationType.SP3D2: 'sp3d2'>]
The supported hybridization modes.
- dict(*args, **kwargs)[source]
Generate a dictionary representation of the model, optionally specifying which fields to include or exclude.