enerzyme.data.transform.BaseTransform#

class enerzyme.data.transform.BaseTransform(major_key: str, *args, **kwargs)[source]#

Bases: ABC

__init__(major_key: str, *args, **kwargs) → None[source]#

inverse_transform(new_output: Dict[str, Iterable], selected_indices: Iterable[int] | None = None) → None[source]#

abstractmethod single_inverse_transform(new_output: Dict[str, Iterable], idx: int) → None[source]#