From: Pijush Ghosh (pijush.ghosh_at_ndsu.edu)
Date: Thu Oct 12 2006 - 11:21:39 CDT
I want to run MD for a total of 60000. However in three steps, first one for
30,000 steps at temperature 300, second one for 20,000 at temperature 325
and third one for 10,000 at temperature 350. I want to do that just by using
one configuration file so that I don't have to manually start the simulation
every time. At the same time I want to make sure I have all the information
saved from each of these three runs.
Can somebody help me with the script.
Department of Civil Engineering
North Dakota State University
Fargo. ND. 58105. USA
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