>From what I can see, there seems to be some significant disagreement within the relax code as to whether the self.relax.data.select_sim data structure should be a simple list, or whether it should be a dictionary indexed by run (where each value is a list).
I favour the dictionary, for two reasons: 1)it is more consistent with the form of other self.relax.data attributes 2)it permits the user to have more than one run doing Monte Carlo sims on a single instance (I can't easily imagine a circumstance where that would be useful, but if flexibility is the goal... ) Either way it will only take a bit of work to make all the references consistent. Any thoughts?
--- Begin Message ---Update of bug #5977 (project relax): Status: Ready For Test => In Progress _______________________________________________________ Follow-up Comment #1: The above fixes have been committed as revision 2503. A further bug is revealed on monte_carlo.error_analysis(): Traceback (most recent call last): File "/home/chris/relax_devel/1.2/relax", line 419, in ? Relax() File "/home/chris/relax_devel/1.2/relax", line 151, in __init__ self.interpreter.run() File "/home/chris/relax_devel/1.2_5698_fix/prompt/interpreter.py", line 213, in run File "/home/chris/relax_devel/1.2_5698_fix/prompt/interpreter.py", line 385, in run_script File "/home/chris/relax_devel/1.2_5698_fix/prompt/interpreter.py", line 340, in interact_script File "relax_diff_mc.py", line 116, in ? monte_carlo.error_analysis(runName) File "/home/chris/relax_devel/1.2_5698_fix/prompt/monte_carlo.py", line 145, in error_analysis File "/home/chris/relax_devel/1.2/generic_fns/monte_carlo.py", line 150, in error_analysis select_sim = return_selected_sim(self.run, instance) File "/home/chris/relax_devel/1.2/specific_fns/model_free.py", line 4456, in sim_return_selected return self.relax.data.select_sim[self.run] TypeError: list indices must be integers Here, self.relax.data.select_sim is a list, whereas the code appears to expect the more normal dictionary indexed by run _______________________________________________________ Reply to this item at: <http://gna.org/bugs/?func=detailitem&item_id=5977> _______________________________________________ Message sent via/by Gna! http://gna.org/
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