13 Jul
2012
13 Jul
'12
3:06 a.m.
Hi Peter and Nat,
On Thu, Jul 12, 2012 at 8:45 AM, Petrus Zwart
wrote: In general, I use a 'map_to_asu' whenever possible, this avoids some problems you illustrate, but isn't elegant.
+1
This is pretty essential for much of our code, assuming you're working with merged/symmetry-unique data.
It would make sense to automagically map to asu in complete_set and complete_array in order to avoid surprises, wouldn't it? Would you see any adverse effect? Best wishes, Luc Bourhis