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AMBER Archive (2009)Subject: [AMBER] How to jude whether the trajectory is stable or not
From: Jeffrey (jeffry20072008_at_yahoo.cn)
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.
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