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where
Boverall is the global
(isotropic) temperature factor that QS assigns to
all atoms of the Nth search model (for example, B_M1 20.0 will
assign a temperature factor of 20.0Å2 to all atoms of model number 1
(corresponding to the file defined by MOD1, see page )).
This only affects the electron density and molecular
transform calculation, because after each Monte Carlo step the Fc's are scaled to
Fo's using an overall scale and temperature factor. A value of about 20 to 30Å2
would be OK for most protein work. Default 20.0Å2.
NMG, January 2005