Re: [gmx-users] Restart without energies

Hi Jordi, Now it's too late, but you can always change the mdp option for the frequency of edr writing, nstenergy option. If it's just some ps, maybe it's not really worth doing much about it. Reruning the simulation to get an energy file it's possible with the -rerun option in mdrun, feeding

[gmx-users] Restart without energies

Hello! I've been running a simulation for a few picoseconds when the machine crashed. The I tryied to use tpbconv, but it said that the .edr file is empty and cannot generate the .tpr file. I suppose that it is due to buffering issues that the .edr file was not written and the .trr file was writte