Saturday, 15 October 2011

Apparent twinning in P 1 21 1 (refmac)

From: Yuri Pompeu
Date: 30 September 2011 03:25

after 1 round of refmac rigid body and restrained refinement with twin law (estimated alpha 0.47)
I am looking at 0.25 -0.29 Rwork Rfree and overall FOM 0.72.
I also defined NCS restraints...

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From: Pavel Afonine
Yuri,

note, the R-factors in case of twinning are not directly comparable. 

Pavel


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