i suspect that this is due to the initial
B-factor correction (default is 'anisotropic'
but you can change this to 'no' if you like)
--dvd
On 28 Mar 2001, Markus Meier wrote:
> Dear all
>> Using the provided script minimize.inp of CNS Ver. 1.0, the B-factors
> are changed comparing input and output file by a small amount of 0.01
> (they are supposed to be constant).
> If I use the script bindividual.inp and fix part of the B-factors in the
> structure the output B-factors are even changed by a larger amount
> (0.11) in the fixed part.
>> I am not happy about this, even though the changes are small. Did anyone
> else have the same problem (and has probably a fix for it)?
>> Thanks
> Markus
>> Markus Meier
> MIH
> Biozentrum der Universitaet Basel
> Basel
> Switzerland
>> ---
>
--gerard
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Gerard J. Kleywegt
Dept. of Cell & Molecular Biology Bolshevik University of Uppsala
Biomedical Centre Box 596
SE-751 24 Uppsala SWEDEN
http://xray.bmc.uu.se/gerard/ mailto:gerard at xray.bmc.uu.se
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The opinions in this message are fictional. Any similarity
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