schrodinger.application.matsci.flywheel.errors module

Exceptions shared by inverse-design generation and screening.

exception schrodinger.application.matsci.flywheel.errors.GeneratorError

Bases: Exception

Raised when an LDMol model cannot load or generate molecules.

exception schrodinger.application.matsci.flywheel.errors.FlyWheelError

Bases: Exception

Raised when flywheel alignment or search state cannot proceed.

exception schrodinger.application.matsci.flywheel.errors.GenerateMoleculeError

Bases: Exception

Raised when inverse-design driver plumbing cannot proceed.

exception schrodinger.application.matsci.flywheel.errors.ScreenError

Bases: Exception

Raised when screening or property evaluation cannot proceed.