[phenixbb] statistics output by phenix.refine

Jianghai Zhu jzhu at cbr.med.harvard.edu
Wed May 16 13:59:19 PDT 2007


Hi Ralf,

Thanks for the answer.  Apparently, I didn't read too carefully :)   
It has almost everything except LLG (total) and LLG (free).  Is it  
possible to output those?

Jianghai

+++++++++++++++++++++++++++++++
Jianghai Zhu, Ph.D
CBR Institute for Biomedical Research
Department of Pathology
Harvard Medical School
200 Longwood Ave., Boston, MA 02115
Ph: 617-278-3211
Fx: 618-278-3232
+++++++++++++++++++++++++++++++



On May 16, 2007, at 4:50 PM, Ralf W. Grosse-Kunstleve wrote:

> Hi Jianghai,
>
> There are two comprehensive sections with statistics of all kinds
> (I think everything you're asking for):
>
> In the log file:
>
> ================= overall refinement statistics: step by step  
> =================
>
> And similar information in REMARK records in the output .pdb file:
>
> REMARK ****************** REFINEMENT STATISTICS STEP BY STEP  
> ******************
>
> Please let us know if you are interested in additional statistics.
>
> Ralf
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> phenixbb at phenix-online.org
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