On 7/11/12 2:08 PM, Shima Arasteh wrote:
Dear gmx friends,How much time should have been spent in NPT equilibrium for
a system composed of protein and water? In Justin's tutorial, I saw it is
100 ps for a system composed of Lysozym and water.
Long enough for the observables of interest to c
Dear gmx friends,How much time should have been spent in NPT equilibrium for a
system composed of protein and water? In Justin's tutorial, I saw it is 100 ps
for a system composed of Lysozym and water.
Thanks in advance.
Sincerely,
Shima
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