[gmx-users] potential energy value

ahmet yıldırım ahmedo047 at gmail.com
Tue Jan 18 10:06:13 CET 2011

Dear users,

I tried the emol values the following:

As emol=2000, Potential energy=-4.7x10^5
As emol=1000, Potential energy=-4.9x10^5
As emol=100, Potential energy=-5.2x10^5

Generally, when we did the energy minimization:

how much potential energy value=?  we can say that the energy minimization
is good.

Thanks in advance
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