[gmx-users] Crashed run

shiva birgani sh.birgani at gmail.com
Mon Dec 6 08:16:46 CET 2010


Dear Justin
I had a crashed run and continued it by tpbconv and mdrun. After that in
order to analysis the results of new MD run I used of this command
trjcat -s md2.tpr -settime
But when I want to compute RMSD, DSSP, ... I do not know how I can put
together the results of MD1 (crashed run) and MD2 (continued one) to have
the homogeneous results.
Could you please help me in this regard?
thanks in advance
Shiva
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