[phenixbb] auto-open MTZ scheme

Ralf W. Grosse-Kunstleve rwgk at cci.lbl.gov
Sat Jan 23 15:29:11 PST 2010


Hi Paul,

> Prompted by Randy Read, Kevin and I have agreed that Coot should be able 
> to auto-open MTZ files with columns labelled
>
> groupname.F_phi.F and groupname.F_phi.phi
>
> and
>
> groupname.DF_phi.DF, groupname.DF_phi.phi for difference maps
>
> for any value of groupname, of course.
>
> (Any weights should be applied to Fs before writing the file).
>
> We were wondering what the Phenix community/developers thought
> about that idea (there's not much point in adding this feature if
> you don't agree).

I would be great to have this feature, but I'm not familiar with
the groupname.DF_phi.DF syntax. Our mtz tools work via "make a new crytal",
"make a new dataset", "make a new column", "add data to the column".
Can this be mapped to your dotted syntax?
Do you have an example mtz file that I could follow?

Ralf



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