openff.bespokefit.schema.tasks.OptimizationTask
- model openff.bespokefit.schema.tasks.OptimizationTask[source]
Bases:
OptimizationTaskSpec
- Fields
- field smiles: str [Required]
A fully indexed SMILES representation of the molecule to optimize.
Bases: OptimizationTaskSpec
A fully indexed SMILES representation of the molecule to optimize.