schrodinger.application.vss.database module¶

class schrodinger.application.vss.database.Database(path)[source]¶

Bases: object

Database metadata.

__init__(path)[source]¶

Parameters: path (str) – Directory path.

get_smiles_csv()[source]¶

get_shape_data(shape_type)[source]¶

count_structures()[source]¶

validate()[source]¶

Returns: Validation success and error message.
Return type: (bool, str)