tdc.oracles#
- class tdc.oracles.Oracle(name, target_smiles=None, num_max_call=None, **kwargs)[source]#
Bases:
object
the oracle class to retrieve any oracle given by query name
- Parameters:
name (str) – the name of the oracle
target_smiles (None, optional) – target smiles for some meta-oracles
num_max_call (None, optional) – number of maximum calls for oracle, used by docking group
**kwargs – additional parameters for some oracles