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AMBER Archive (2001)Subject: sander_classic: bond energy problem
From: Miyashita, Osamu (omiyashita_at_ucsd.edu)
Hi Everyone,
I have a problem for running sander_classic. The bond energy in the output shows
For the same structure
Angle and torsion energies are same for both cut off distance.
I tried to make all parameters in size.h, but it doesn't change.
Host is MIPS R10000 IRIX64 version 6.5. I am using SGI compiler.
What is the problem? I shall attache my two output files for cutoff 8 (min_8_out) and cutoff 20 (min_20_out). Please help me.
Thank you.
Osamu
Attachment Converted: "c:\eudora\attach\min_20_out.txt"
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