diff --git a/.idea/workspace.xml b/.idea/workspace.xml index 0243f3d..e5089d7 100644 --- a/.idea/workspace.xml +++ b/.idea/workspace.xml @@ -3,8 +3,6 @@ - - @@ -362,7 +367,8 @@ - @@ -386,10 +392,10 @@ - + - + diff --git a/docs/Examples/iterative_fitter.py b/docs/Examples/iterative_fitter.py index 37d8218..9092deb 100644 --- a/docs/Examples/iterative_fitter.py +++ b/docs/Examples/iterative_fitter.py @@ -45,6 +45,7 @@ i = 0 rel_diff = 1000 while rel_diff > 1e-4: i += 1 + print(i) best_obj = 1e20 output_dict['iter'].append(i) for species in species_list: @@ -57,7 +58,8 @@ while rel_diff > 1e-4: 'Cphi': [], 'obj_value': [], 'guess': []} - for x_guess in x_guesses: + for ind1, x_guess in enumerate(x_guesses): + print(ind1) info_dict = {'(HA)2(org)_h0': {'upper_element_name': 'species', 'upper_attrib_name': 'name', 'upper_attrib_value': '(HA)2(org)',