GuinierTools.GuinierDeviation

GuinierTools.GuinierDeviation — re-exports from molass-library canonical location.

The active implementation lives in molass.Guinier.GuinierDeviation. This module exists for backward compatibility with callers that import from molass_legacy.GuinierTools.GuinierDeviation.

Canonical usage:

from molass.Guinier.GuinierDeviation import GuinierDeviation
from molass.Guinier.GuinierDeviation import USE_NORMALIZED_RMSD_FOR_RGCURVES

Legacy usage (still works):

from molass_legacy.GuinierTools.GuinierDeviation import GuinierDeviation
from molass_legacy.GuinierTools.GuinierDeviation import USE_NORMALIZED_RMSD_FOR_RGCURVES

class GuinierDeviation(qv, rg_curve, rg_params, region_limit=0, composite=None)

Bases: object

compute_deviation(P, Cxr, rg_params, valid_components=None, return_details=False, debug=False)

compute_rgcurve_deviation(Cxr, rg_params, adjust=0, debug=False)

update_region(rg_params, region_limit, P=None, M=None, E=None, debug=False)