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{ version = 1.11; (* of diri.p 2005 Oct 20}
(* begin module describe.diri *)
(*
name
diri: finds the information for all sites in a flex model
synopsis
diri(ari: in, bri: in, histog, in: dcout: out, output: out)
files
ari: rixyin from ri file for model A
bri: rixyin from ri file for model B
histog: output of the genhis file containing the binding distribution
between model A and B, the user should use diffinst then genhis
to generate this file.
dcout: reports the coordinates and flexible information for all sites.
description
Diri takes the rixyin output of ri for two models and uses the binding
distribution, from histog to determine the flexible information for all
sites in a variable model. This is the same value as discan gives.
examples
documentation
see also
The flexrbs paper uses this program:
https://alum.mit.edu/www/toms/papers/flexrbs/
Instructions for using this program:
https://alum.mit.edu/www/toms/paper/flexrbs/refineinst.html
The makeinst program will convert dcout to Delila instructions:
https://alum.mit.edu/www/toms/delila/makeinst.html
Related programs: discan.p, diffinst.p, ri.p
author
Rye Shultzaberger
bugs
Diri checks to see if the absolute value of the difference between the A
coordinate and B coordinate is equal to any absolute value of a distance
in the histog. If your model can have a positive or negative spacing,
this program will hit both spacings and will report the total information
for both spacings. This is not an issue for most of the applications of
this, where the one component is either always upstream or downstream of
the other component.
technical notes
*)
(* end module describe.diri *)
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