Paul Emsley wrote:
Francois Berenger wrote:
When I run coot in order to read the experimental MTZ corresponding
to the PDB I am viewing, [snip]
I am afraid coot is refining my molecule instead of just displaying
the map.
Well, Refmac is - at Coot's request.
This usually happens because Coot doesn't detect phases in your MTZ file
(i.e. you are using a phasing input file, rather than an output file).
Or it could be a bug.
Hello Paul,
Yes, my MTZ doesn't have phase, it is not supposed to.
But, as Bernhard C. Lohkamp just pointed out 3 minutes before on this
same mailing list: does the fact that "NCYCLES 0" is present means that
refmac would just compute a map and not do any refinement of my PDB?
From the refmac documentation, and not being a crystallographer (sorry
for this fact), it is completely not clear for me.
Thanks a lot,
Francois.
