[AMBER] Making Ambiguous Distance Restraints

From: Titus, Jamie (bairdje) <"Titus,>
Date: Mon, 11 Jan 2010 09:53:20 -0500

Hello all,

After searching the archive, I am still attempting to make ambiguous distance restraints. It appears that the amber10 manual procedure for making ambiguous restraints may not be functional (per posting http://archive.ambermd.org/200905/0309.html and discussions with the poster in that thread). If making ambiguous distance restraints with makeDIST_RST will not work, could someone please post the sander &rst format for making these restraints. I am not sure how to make a restraint ambiguous in this format....

#36 GUA H8 0 AMB pd_1.88 6
&rst
  ixpk= __, nxpk= __, iat= _____, r1= ___, r2= ___, r3= ___, r4= ___
 igr1= ____
 igr2= ____
 &end

??

Thanks!
Jamie
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Received on Mon Jan 11 2010 - 07:00:03 PST
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