Author: tlinnet Date: Tue Aug 12 10:54:52 2014 New Revision: 24990 URL: http://svn.gna.org/viewcvs/relax?rev=24990&view=rev Log: Replaced the test, if acquiring the model info to a numerical model from a analytical model. sr #3135(https://gna.org/support/?3135): Optimisation of the R1 relaxation rate for the off-resonance R1rho relaxation dispersion models. Modified: branches/R1_fitting/auto_analyses/relax_disp.py Modified: branches/R1_fitting/auto_analyses/relax_disp.py URL: http://svn.gna.org/viewcvs/relax/branches/R1_fitting/auto_analyses/relax_disp.py?rev=24990&r1=24989&r2=24990&view=diff ============================================================================== --- branches/R1_fitting/auto_analyses/relax_disp.py (original) +++ branches/R1_fitting/auto_analyses/relax_disp.py Tue Aug 12 10:54:52 2014 @@ -39,7 +39,7 @@ from specific_analyses.relax_disp.data import has_exponential_exp_type, has_cpmg_exp_type, has_fixed_time_exp_type, has_r1rho_exp_type, loop_frq from specific_analyses.relax_disp.data import INTERPOLATE_DISP, INTERPOLATE_OFFSET, X_AXIS_DISP, X_AXIS_W_EFF, X_AXIS_THETA, Y_AXIS_R2_R1RHO, Y_AXIS_R2_EFF from specific_analyses.relax_disp.variables import nesting_model -from specific_analyses.relax_disp.variables import MODEL_CR72, MODEL_CR72_FULL, MODEL_LIST_ANALYTIC, MODEL_LIST_NEST, MODEL_LIST_NUMERIC, MODEL_LIST_R1RHO_FIT_R1, MODEL_LIST_R1RHO_W_R1, MODEL_LIST_R1RHO_FULL, MODEL_LM63, MODEL_LM63_3SITE, MODEL_MP05, MODEL_MMQ_CR72, MODEL_NOREX, MODEL_NOREX_R1RHO, MODEL_NOREX_R1RHO_FIT_R1, MODEL_NS_CPMG_2SITE_3D, MODEL_NS_CPMG_2SITE_3D_FULL, MODEL_NS_CPMG_2SITE_EXPANDED, MODEL_NS_CPMG_2SITE_STAR, MODEL_NS_CPMG_2SITE_STAR_FULL, MODEL_NS_MMQ_2SITE, MODEL_NS_MMQ_3SITE, MODEL_NS_MMQ_3SITE_LINEAR, MODEL_NS_R1RHO_2SITE, MODEL_NS_R1RHO_3SITE, MODEL_NS_R1RHO_3SITE_LINEAR, MODEL_PARAM_R20B, MODEL_PARAMS, MODEL_R2EFF, PARAMS_R20 +from specific_analyses.relax_disp.variables import EQ_ANALYTIC, EQ_NUMERIC, EQ_SILICO, MODEL_CR72, MODEL_CR72_FULL, MODEL_LIST_ANALYTIC, MODEL_LIST_NEST, MODEL_LIST_NUMERIC, MODEL_LIST_R1RHO_FIT_R1, MODEL_LIST_R1RHO_W_R1, MODEL_LIST_R1RHO_FULL, MODEL_LM63, MODEL_LM63_3SITE, MODEL_MP05, MODEL_MMQ_CR72, MODEL_NOREX, MODEL_NOREX_R1RHO, MODEL_NOREX_R1RHO_FIT_R1, MODEL_NS_CPMG_2SITE_3D, MODEL_NS_CPMG_2SITE_3D_FULL, MODEL_NS_CPMG_2SITE_EXPANDED, MODEL_NS_CPMG_2SITE_STAR, MODEL_NS_CPMG_2SITE_STAR_FULL, MODEL_NS_MMQ_2SITE, MODEL_NS_MMQ_3SITE, MODEL_NS_MMQ_3SITE_LINEAR, MODEL_NS_R1RHO_2SITE, MODEL_NS_R1RHO_3SITE, MODEL_NS_R1RHO_3SITE_LINEAR, MODEL_PARAM_R20B, MODEL_PARAMS, MODEL_R2EFF, PARAMS_R20 from status import Status; status = Status() @@ -293,23 +293,16 @@ else: nested_pipe = None - - # Using the analytic solution. - analytic = False - if model in [MODEL_NS_CPMG_2SITE_3D, MODEL_NS_CPMG_2SITE_EXPANDED, MODEL_NS_CPMG_2SITE_STAR] and MODEL_CR72 in self.models: - nested_pipe = self.name_pipe(MODEL_CR72) - analytic = True - elif model == MODEL_NS_MMQ_2SITE and MODEL_MMQ_CR72 in self.models: - nested_pipe = self.name_pipe(MODEL_MMQ_CR72) - analytic = True - if model == MODEL_NS_R1RHO_2SITE and MODEL_MP05 in self.models: - nested_pipe = self.name_pipe(MODEL_MP05) - analytic = True - # No nesting. if not nested_pipe: print("No model nesting or model equivalence detected.") return False + + # Using the analytic solution. + if model_info.eq in [EQ_NUMERIC, EQ_SILICO] and comparable_model_info.eq == EQ_ANALYTIC: + analytic = True + else: + analytic = False # Printout. if analytic: