[phenixbb] Refining with NCS
Pavel Afonine
PAfonine at lbl.gov
Mon Aug 25 10:59:37 PDT 2008
Hi Francis,
> Also if anyone has a paper/protocol for NCS refinement, I'd love to
> check it out (to figure out which map to fit to).
Just something to keep in mind... I always prefer to run two refinements
in parallel with and without using NCS. It's resolution (and
data-to-parameters ratio) dependent. I've seen a number of cases where
using the NCS is very beneficial and similar number of cases where it's
better to not use NCS (mostly at resolutions ~2-2.5A).
I would also check manually the NCS groups that are found by
phenix.refine automatically. I have some cases where automatic detection
did not yield a good selection.
Pavel.
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