On 31/12/2011 7:03 AM, César Ávila wrote:
Dear all,
perhaps someone can help me with this doubt. When a REMD simulation is
run, which configuration is stored for any given replica, the one
before the exchange or the one that we get after the exchange (i.e.
the exchange partner configuration)?
Replica exchange occurs after all output - it's essentially the last
thing that happens in the main loop.
Mark
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