[gmx-users] folding of coordinates in trajectory files

Gavin Melaugh gmelaugh01 at qub.ac.uk
Mon Mar 5 16:59:07 CET 2012

Hi All

I was wondering. I assume gromacs writes folded coordinates in the
trajectory files. If so
does it use

rx(i) = rx(i) -boxl *nint(rx(i) / boxl)

to fold the coordinates at each step?
and where does it define the origin (0,0,0)


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