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Category refine_funct_minimized
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Category Description
Data items in the REFINE_FUNCT_MINIMIZED category record
details about the individual terms of the function minimized
during refinement.
Category Examples
Example 1:
Example 1 - based on RESTRAIN refinement for the CCP4 text data set
toxd.
loop_
_refine_funct_minimized.type
_refine_funct_minimized.number_terms
_refine_funct_minimized.residual
'sum(W*Delta(Amplitude)^2' 3009 1621.3
'sum(W*Delta(Plane+Rigid)^2' 85 56.68
'sum(W*Delta(Distance)^2' 1219 163.59
'sum(W*Delta(U-tempfactors)^2' 1192 69.338
Key Category Items
Items in Category refine_funct_minimized
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This HTML dictionary was created using the
CIFLIB C Language Application Program Interface
at the
Resource Collaboratory for Structural Bioinformatics
Rutgers University, Department of Chemistry
New Brunswick, New Jersey
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