Re: [gmx-users] tpbconv functionality

Hi Cesar, Not with tpbconv. You can do it with grompp, adding the .trr end .edr file you have as input and making sure that you don't generate new velocities and set unconstrained_start to yes. Cheers, Tsjerk On Sun, Jun 29, 2008 at 10:18 PM, Cesar Avila <[EMAIL PROTECTED]> wrote: > I found the

[gmx-users] tpbconv functionality

I found the tpbconv tool very usefull for generating tpr files for resuming the simulations. Nevertheless I couldn't find an option to set/change the number of processors to use as the -np option in grompp. Is there a way to do this? ___ gmx-users mailin