[phenixbb] occupancy refinement
pafonine at lbl.gov
Thu Nov 25 13:04:41 PST 2010
> thank you for your prompt answer. You understood me correctly:
>> constraint #1: occupancy(AGLU A 30) + occupancy(BGLU A 30)=1
>> constraint #2: occupancy(AGLU A 30) = occupancy(AALA A 451)
> is exactly what I want. Nevertheless, this can be done in SHELXL, but I
> hoped it could be done in phenix.refine too.
Ok, this is exactly what phenix.refine does automatically. I said it in
previous email, and this is what is written in the documentation:
All the best!
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