Source code for stko._internal.calculators.results.shape_results

from collections import abc




class ShapeResults:
    """Results class containing molecule shape measures."""

    def __init__(self, generator: abc.Iterable) -> None:
        self._values = next(generator)  # type: ignore[call-overload]



    def get_pmi1(self) -> float:
        return self._values["pmi1"]




    def get_pmi2(self) -> float:
        return self._values["pmi2"]




    def get_pmi3(self) -> float:
        return self._values["pmi3"]




    def get_npr1(self) -> float:
        return self._values["npr1"]




    def get_npr2(self) -> float:
        return self._values["npr2"]




    def get_asphericity(self) -> float:
        return self._values["asphericity"]




    def get_eccentricity(self) -> float:
        return self._values["eccentricity"]




    def get_inertial_shape_factor(self) -> float:
        return self._values["inertialshapefactor"]




    def get_radius_of_gyration(self) -> float:
        return self._values["radiusofgyration"]




    def get_spherocity_index(self) -> float:
        return self._values["spherocityindex"]