[gmx-users] eneconv error

chris.neale at utoronto.ca chris.neale at utoronto.ca
Tue Jan 30 18:05:06 CET 2007

Could be because single precision times are not exact and if you are  
using grompp restarts and not tpbconv then your first file might end  
at time 200.0001 ps and the next one starts at 200ps or some variation  
on this. One option to get around this for now is to first eneconv  
your files so that they don't contain any overlapping frames (e.g.  
take the last frame off each file) and then eneconv them together.


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