[AMBER] How to jude whether the trajectory is stable or not

From: Jeffrey <jeffry20072008.yahoo.cn>
Date: Fri, 13 Feb 2009 10:33:53 +0800

Dear all,

    I'd like to jude whether I have produced a stable trajectory under CPT ensemble. Could someone please tell me how to judge? By monitoring the energy terms, temperature, pressure, density, box length etc. during the simulation course?

Thanks very much.
Have a nice day.

-----
Jeffrey


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Received on Fri Feb 13 2009 - 01:23:13 PST
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