Re: [ccp4bb]: Is it possible to write out Fc_solvent and Fc_TLS in REFMAC?

[Garib N Murshudov <garib@ysbl.york.ac.uk>]

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At the moment it is not possible. It can be added. How it should be written 
out: after scaling or before scaling. Bulk solvent correction is not added to 
Fcalc. 
What you can do is to write out mask itself. If you specify in command line
MSKOUT <file_name> then program should write out mask file as ccp4 map file.


Garib

On Tuesday 25 Jun 2002 9:32 pm, Yong Xiong wrote:
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>
> Hopefully I am not asking too much. Whether it is possible to write out the
> partial contributions from bulk solvent diffraction and/or TLS model in
> REFMAC? By this I mean the Fc's of the bulk solvent model and TLS model
> (They are added onto the atomic model for the final Fcal any way).
>
> Thanks!
>
> Yong

-- 
Garib N. Murshudov, Chemistr Department, University of York
Tel: (01904) 432565