AMBER Archive (2004)

Subject: AMBER: NTT=4

From: Joachim Reichelt (Reichelt_at_gbf.de)
Date: Tue May 18 2004 - 09:30:33 CDT

Dear all,

I have setup a little "instable" system. I want to do md using little
steps and
NTT=4 to catch flying atoms.
Is there a temperature scaling possible?
I think of having both active as in NTT=1 and NTT=4 

-- 
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         Joachim Reichelt

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Standard > Keyword : Opinions, my own, nobody else's, whatsoever ...

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