ncsw_data.storage.cacs.sqlite_db.model.workbench.reaction

The ncsw_data.storage.cacs.sqlite_db.model.workbench package reaction module.

Classes

CaCSSQLiteDatabaseModelWorkbenchReaction

The computer-assisted chemical synthesis (CaCS) SQLite database model workbench chemical reaction class.

Module Contents

class ncsw_data.storage.cacs.sqlite_db.model.workbench.reaction.CaCSSQLiteDatabaseModelWorkbenchReaction

Bases: ncsw_data.storage.cacs.sqlite_db.model.base.base.CaCSSQLiteDatabaseModelBase, ncsw_data.storage.cacs.sqlite_db.model.base.mixin.CaCSSQLiteDatabaseModelReprMethodMixin, ncsw_data.storage.cacs.sqlite_db.model.base.mixin.CaCSSQLiteDatabaseModelTimestampColumnsMixin

The computer-assisted chemical synthesis (CaCS) SQLite database model workbench chemical reaction class.

__tablename__ = 'workbench_reaction'

id: sqlalchemy.orm.Mapped[int]

smiles: sqlalchemy.orm.Mapped[str]

archive_reactions

workbench_reactant_compounds

workbench_spectator_compounds

workbench_product_compounds

workbench_reaction_patterns