AMBER: lastrst

From: Stern, Julie <jvstern.bnl.gov>
Date: Tue, 22 Feb 2005 20:21:00 -0500

I keep getting the following error message no matter how large I make
lastrst
in my minimization file as if it weren't reading what I'm setting. I even
went as high as 10e+32.

Any suggestions?


Exceeding lastrst in get_stack
   lastrst = 3564
   top_stk= 0
   isize = 22133
   request= 22133
  Increase lastrst in the &cntrl namelist

Minimization intpminimization
&cntrl
   imin=1,
   ncyc=250,
   maxcyc=1000,
   lastrst=8000000,
   lastist=8000000,
   ntf=1,
   ntc=1,
   ntpr=10,
   igb=0,
   ntb=1,
   cut=3.0,
   ibelly=1,
   bellymask='!.SA',
&end


>From the minimization output:

| Memory Use Allocated
| Real 89727
| Hollerith 69
| Integer 42095
| Max Pairs 55
| Max Rstack 3564
| Max Istack 55
| Total 893 kbytes
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Received on Wed Feb 23 2005 - 01:53:00 PST
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