Re: [gmx-users] using old energies

2007-06-06 Thread David van der Spoel
lorix wrote: Hi everyone, I am simulating proteins in water at the equilibrium. I try to run new simulations with a short protein (deleting atoms from the previous .gro file). I understood that gromacs stores the atom velocities in the .gro file but also in the .edr file! I would like to use

[gmx-users] using old energies

2007-06-05 Thread lorix
Hi everyone, I am simulating proteins in water at the equilibrium. I try to run new simulations with a short protein (deleting atoms from the previous .gro file). I understood that gromacs stores the atom velocities in the .gro file but also in the .edr file! I would like to use the atom