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class Molecule

W&B class for 3D Molecular data.

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method Molecule.__init__

__init__(  data_or_path: Union[str, pathlib.Path, ForwardRef('TextIO')],  caption: Optional[str] = None,  **kwargs: str ) → None
Initialize a Molecule object. Args:
  • data_or_path: Molecule can be initialized from a file name or an io object.
  • caption: Caption associated with the molecule for display.
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