I have a restraints file read in that looks like this:
MODELLER5 VERSION: MODELLER FORMAT
R 3 1 11 34 1 2 0 3520 -16.00 0.01
R 3 1 11 34 1 2 0 3546 -16.00 0.01
R 3 1 11 34 1 2 0 3575 -16.00 0.01
And in my TOP file I add the restraint as follows:
SUBROUTINE ROUTINE = 'special_restraints'
READ_RESTRAINTS FILE = 'restraints.rsr'
SET ADD_RESTRAINTS = on
RETURN
END_SUBROUTINE
But it doesn't do anything. I am pretty sure that
I am calling on everything correctly, and I
have seen this problem posted by others before.
Any idea?
Thanks
Michael
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Michael Grabe, Ph.D.
Post-doctoral Fellow
Howard Hughes Medical Institute
University of California, San Francisco
1550 4th Street GD482
San Francisco, CA 94143