[gmx-users] How do you print positions in double precision
ckutzne at gwdg.de
Tue Aug 19 10:06:02 CEST 2014
On 19 Aug 2014, at 09:32, Jackson Chief Elk <jchiefelk at gmail.com> wrote:
> I have gone through the procedure of installing version 5.0 in double precision with CMAKE, however the positions are still printing in single precision mode. I need the extra precision to calculate dipole correlation function for confined water system, anybody run into this precision issue?
trjconv -s your.tpr -f your.trr -o out.gro -ndec 25
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