schrodinger.comparison.exceptions module

Custom Exceptions used in comparison module

exception schrodinger.comparison.exceptions.ConformerError

Bases: TypeError

Indicates two structures are not conformers

exception schrodinger.comparison.exceptions.AbortException

Bases: ValueError

Indicates that the early stopping criterion was reached

exception schrodinger.comparison.exceptions.CSPError

Bases: Exception

Generic error raised during crystal structure prediction workflow.

exception schrodinger.comparison.exceptions.RMSDnError

Bases: Exception

Error raised during crystal structure alignment.