Dear Amber users,
I have been running Accelerated MD on my system. I set up my aMD parameters as explained on the Amber manual:
from 10ns MD results (trajectory from 50 to 60 ns).
I used these parameters as follow:
&cntrl
I am running aMD at 298K but in the output file I noticed
that the temperature raises a lot from 298K to about 320K (please see file attached).
Many thanks for your help.
Regards.
OZ
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Received on Mon Nov 04 2013 - 00:00:02 PST