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
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