[AMBER] a question about replica exchange

From: Albert <mailmd2011.gmail.com>
Date: Mon, 15 Oct 2012 08:19:36 +0200

hello:

  I find that most REMD were produced in implicit solvent and I've got a
question for that:

it is no doubt that our protein is of many charges and the total charge
of the REMD system is not zero. How Amber avoid MD errors from this issue?

thank you very much
best
Albert

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Received on Sun Oct 14 2012 - 23:30:05 PDT
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