[phenixbb] R-factor calculation
Pavel Afonine
pafonine at lbl.gov
Wed Jun 20 13:09:10 PDT 2012
Hi Abhinav,
just type
phenix.model_vs_data
without arguments and it will print some hints. This works for most
command line tools, but I agree consistency would be helpful.
Pavel
On 6/20/12 1:06 PM, Abhinav Kumar wrote:
> Thanks Pavel. It works.
>
> I earlier tried "high_resolution 2.0" which didn't work since I missed
> the '=' sign.
> Maybe it's useful to print out options/examples. Currently,
> phenix.model_vs_data --help or (-h) gives
> Sorry: No reflection file found.
>
> I am using phenix-1.7.3-928 version.
>
> Abhinav
>
> JCSG at SSRL, SLAC
> (650) 926-2992
>
> On 06/20/2012 12:39 PM, Pavel Afonine wrote:
>> Hi Abhinav,
>>
>>> Is it possible to specify a different high resolution cutoff (than
>>> what's in data file) in phenix.model_vs_data for R-factors calculation?
>> yes:
>>
>> phenix.model_vs_data model.pdb data.mtz high_resolution=2.5
>>
>> Pavel
>>
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>
>
>
>
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