from bumps.names import * from sasmodels.data import load_data from sasmodels.core import load_model from sasmodels.bumps_model import Model, Experiment # Spherical particle data, not ellipsoids sans, usans = load_data('latex_smeared.xml', index='all') usans.qmin, usans.qmax = np.min(usans.x), np.max(usans.x) usans.mask = (usans.x < 0.0) usans.oriented = True #print sans.dxl, usans.dxl #import pprint; pprint.pprint(sans.__dict__) kernel = load_model("ellipsoid") model = Model( kernel, scale=0.08, background=0, sld=.291, sld_solvent=7.105, radius_polar=1800, radius_polar_pd=0.222296, radius_polar_pd_n=0, radius_equatorial=2600, radius_equatorial_pd=0.28, radius_equatorial_pd_n=0, theta=60, theta_pd=0, theta_pd_n=0, phi=60, phi_pd=0, phi_pd_n=0, ) # SET THE FITTING PARAMETERS model.radius_polar.range(1000, 10000) model.radius_equatorial.range(1000, 10000) model.theta.range(0, 360) model.phi.range(0, 360) model.background.range(0,1000) model.scale.range(0, 10) #cutoff = 0 # no cutoff on polydisperisity loops #cutoff = 1e-5 # default cutoff cutoff = 1e-3 # low precision cutoff M = Experiment(data=usans, model=model, cutoff=cutoff) problem = FitProblem(M)