On 4/29/2011 4:48 AM, shivangi nangia wrote:
Dear gmx users,
I am using g_velacc to calculate the velocity auto correlation. The
output I am getting in .xvg file is much lower precision than I require.
Is there a way to get the values in higher precision?
Depends what you've done so far, but either you need to collect velocity
data more often, or in double precision, or both.
Mark
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