[Xplor-nih] final structure calculation

[Andrew Severin]

Hello everyone,

   I was wondering what scripts are typically used when you are close to
finishing the structure calculation.  I am currently using refine.py and it
outputs an ave.pdb file.   I also have found a non-python script
average.inpin analyze_sry folder in eginput of the xplor-nih main
folder.  I am looking
for a protocol or method for determining the final set of structures when
you are very close.
Also, how many structures are typically done in the final structure
calculation? 100? 200?  Of that what percent is acceptable to submit as a
final cluster 20%, 10%?

thanks in advance,


Andrew Severin
Graduate Student
Iowa State University
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