[gmx-users] scale tabulated non-bonded potentials?

[Mark Abraham]

Hi,

I've no idea what you're trying to solve, so it's a bit hard to help...

Mark
On Jan 16, 2014 10:04 AM, "Steven Neumann" <s.neumann08 at gmail.com> wrote:

> Thanks. Yes, is there in [ atomtypes ] ? So tables are scaled even
> non-Lennard Jones? I have 5 types of beads so 15 tables...in each only last
> two non-zero columns - potential and its derivative present.  How can I  I
> scale it by 0.5 for example?
>
> Steven
>
>
> On Wed, Jan 15, 2014 at 10:30 PM, Mark Abraham <mark.j.abraham at gmail.com
> >wrote:
>
> > Yes, they get multiplied by parameters like charge, C6, C12 etc. Is that
> > the question you're asking? :-)
> >
> > Mark
> >
> >
> > On Wed, Jan 15, 2014 at 8:02 PM, Steven Neumann <s.neumann08 at gmail.com
> > >wrote:
> >
> > > Dear Gmx Users,
> > >
> > > Is there any way in Gromacs to scale tabulated potentials from
> > > energygrp_table (non-bonded)?
> > >
> > > Steven
> > > --
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