peppr.get_fraction_of_rama_outliers#

peppr.get_fraction_of_rama_outliers(atom_array: AtomArray) → float[source]#

Compute the fraction of Ramachandran outliers for given structure.

Parameters:

atom_arraystruc.AtomArray: The AtomArray or AtomArrayStack containing the structure(s).

Returns:

float: The fraction of Ramachandran outliers in the structure, calculated as the number of outlier Ramachandran angles divided by the total number of Ramachandran angles.