This is possible but a bit of a pain.. - you need to make an mtz file,
convert it to the "multi record " format, go through a scala step to
reformat that then you get back to the mtz with
h k l Fmean Dano F+ F- Imean I+ I- all on one line..
I have such a script but it is not part of the Reflection data utilities
- convert to MTZ
It probably should be part of the Convert to MTz GUI
Eleanor
claudine mayer wrote:
> Hello all and Hello Kevin,
>
> I just have by now a probleme concerning this point and especially
> concerning a CNS reflection file with PHASES. The main point is that
> CNS consider Bijvooet as separate reflections (and far away from each
> other in the file) whereas CCP4 uses 1 line for Bijvooet pairs.
> Without considering all the other problems in terms of format, but
> this I guess is only a question of a good script...
>
> Has anybody already think about this problem ?
>
> Cheers,
> Claudine
>
> Kevin Cowtan wrote:
>
>> On a more general note, having looked at mtz2various it looks a lot
>> better than last time I used it, and the problem of keeping I's is a
>> separate issue.
>>
>> But we still get fairly regular format conversion questions on both
>> this and the coot list. From memory, the most common questions
>> concern conversion from CNS format into MTZ. (We've got code to make
>> coot read CNS maps, which may solve this eventually, but it's not in
>> coot yet).
>>
>> Is that correct? Are there any other format conversions which still
>> cause problems?
>>
>> Kevin
>>
>>
>
>
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