[gmx-users] interval simulation
soumadwip ghosh
soumadwipghosh at gmail.com
Mon Jun 29 11:12:57 CEST 2015
Hi,
Use tpbconv in connection with the -time to extend or -until flag. Here
you specify the time (10 ns in your case) by which you want to extend it.
The tpbconv tool will generate a new .tpr file corresponding to 10 ns (in
your case). Now, issue mdrun as below
mdrun_mpi -s new.tpr -v -deffnm your files to be appended -cpi x.cpt file
of yours ..
Hope it helps
Cheers
Soumadwip
More information about the gromacs.org_gmx-users
mailing list