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Re: [ccp4bb] Transferring a Free R set. |
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CCP4bb navigationCCP4bb <-- 1999 <-- November 1999 <-- 30 November 1999Subject: Re: Transferring a Free R set. From: Eleanor Dodson ccp4 {- at -} YSBL {- dot -} YORK {- dot -} AC {- dot -} UK Date: 2008-12-22 Alun R. Coker wrote: > Hi All, > > I have been in the habit of transferring my initial free R assignments > to any new data sets or to isomorphous data sets such as substrate > complexes. Although theoretically this is necessary to obtain a valid > free R many of my colleagues maintain that this is completely > unnecessary in practice. Does anyone on the list have a view on this > or has anyone tested to see if it makes any difference. > > Alun. > I believe it is important, especially at the initial stages of a new refinement. Of course if you dont your FreeR values will climb remorsely back to a proper value, but it is depressing watch it rise and means the initial cycles are not properly weighted.. Eleanor CCP4bb navigationCCP4bb <-- 1999 <-- November 1999 <-- 30 November 1999 |
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