not using SHAKE

From: Eoin Galligan <>
Date: Wed 7 Feb 2001 13:27:24 +0000 (GMT)

Dear all
I'm am not using SHAKE in some dynamics due to previously encountered
errors. However, I now face v.high energies ie they read "****". I have
tried using shake on only h-bonds however without success. If shake is not
used are there any other flags that are required?

Regards, E.Galligan

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Received on Wed Feb 07 2001 - 05:27:24 PST
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