[gmx-users] restarting a crashed job

Hello, My simulation crashed in the middle and I used the -cpi checkpoint.cpt -append option to continue. However, GROMACS cannot continue and complains about not being able to open the corresponding .trr file. I checked my folder, the trr file is there and the name is the same as the *.tpr and

Re: [gmx-users] restarting a crashed job

On 30/08/2011 1:14 PM, Payman Pirzadeh wrote: Hello, My simulation crashed in the middle and I used the /--cpi checkpoint.cpt --append/ option to continue. However, GROMACS cannot continue and complains about not being able to open the corresponding .trr file. I checked my folder, the trr