AMBER Archive (2004)

Subject: AMBER: restrain one tosion angle

From: Yaroslava Yingling (
Date: Fri Oct 08 2004 - 14:02:01 CDT


I would like to restrain one torsion angle in one residue in a molecule. I tried
 the following input
   IRESID=0, IAT=386,387,389,398,
   nstep1=0, nstep2=2000000, imult=0,
   ialtd=0,r2=-160.0, r3=-120.0, rk2=80, rk3=80.0,

However, no restrains have been recognised. I obviously missing something. I
will appreciate some help...



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