[gmx-users] increasing simulation time via temperature rising
nazli kashani javid
nazlikjavid at gmail.com
Mon May 18 08:48:24 CEST 2015
I'm studying effect of temperature on incredibly stable protein. I've
started simulating at 300K then, 400K and 500K. 30ns simulating takes about
4days for these three temperature in a same system. when I want to run 30ns
simulation at 600K, it will take more than 20 days!!!!
does rising temperature, have any affect on time of simulation?
is this increasing in time reasonable?
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