{ xrefin-optimize-B-statement } END
is an xrefin statement. Action takes place as soon as the END
statement is issued.
xrefin-optimize-B-statement:==
ASIGma=selection=real
specifies the target standard
deviation
between B-factors of selected atoms connected by an
angle
. Multiple specification is possible
( default: none).
BFMIn=real
specifies the minimum B-factor allowed
( default: 2.0 Å).
BSIGma=selection=real
specifies the target standard
deviation
between B-factors of selected bonded atoms
.
Multiple specification is possible
(default: none).
DROP=real
is the initial expected drop in energy (
default: 10.0).
NSTEp=integer
is the number of conjugate gradient steps
( default: 0).
RWEIght=real
is the weight for B-factor restraints.
If negative, weight
will be set automatically. If zero, no restraints will be computed
(default: -1).