[gmx-users] g_density options

I'm a GROMACS user and I want to authomatize solvent parametrization in GROMOS force-field. The parametrization of a solvent converg also on the density. The problem is that g_density always ask on which element of the system compute the density and it is waiting for a replay that I can't

Re: [gmx-users] g_density options

vferra...@units.it wrote: I'm a GROMACS user and I want to authomatize solvent parametrization in GROMOS force-field. The parametrization of a solvent converg also on the density. The problem is that g_density always ask on which element of the system compute the density and it is waiting for

Re: [gmx-users] g_density options

Justin A. Lemkul wrote: vferra...@units.it wrote: I'm a GROMACS user and I want to authomatize solvent parametrization in GROMOS force-field. The parametrization of a solvent converg also on the density. The problem is that g_density always ask on which element of the system compute the

Re: [gmx-users] g_density options

vferra...@units.it wrote: Thanks a lot, but... How can I exctract density information by using g_energy? Have you tried it? You're given a list from which to choose. Type the number of the property you want (i.e., Density), then either a blank line or the number zero to terminate