So that you can slice over the components of a map as if it was a sequence, which we claim it is anyway...
Possibly also special support for map[ComponentStatus.Completed] to return a list of output for completed components without blocking or the user needing to do the checking. Or perhaps that should just be some method...
An interface between the Materials Project software suite and the Schrodinger Python API, designed to allow for high-throughput execution of Jaguar and AutoTS calculations for molecular thermodynamics and kinetics.
So that you can slice over the components of a map as if it was a sequence, which we claim it is anyway...
Possibly also special support for
map[ComponentStatus.Completed]to return a list of output for completed components without blocking or the user needing to do the checking. Or perhaps that should just be some method...