[AMBER] MM-PBSA error while running heat.in

From: Vikas Sharma <vs_vikassharma.yahoo.co.in>
Date: Mon, 6 Apr 2009 10:32:55 +0100

Dear Amber users & developers
 
I ma using MM-PBSA..
i ma using advanced tutorials 3..the change that i have made is that i have use TIP#PBOX 8.0 instead of 12.0..
Except that i have followed the same tutorial...
when i checked the heat.out file the error is :
     vlimit exceeded for step 34,37
     
     Note: there is some deeper problem with the energetics of the system.
 
Please Help???
 
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Received on Wed Apr 08 2009 - 01:07:26 PDT
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