vt.edu
> To: gmx-users@gromacs.org
> Subject: Re: [gmx-users] umbrella potential
>
>
>
> Stefan Hoorman wrote:
> > I have performed a series of umbrella sampling simulations in order to
> > do a WHAM analysis. The profile.xvg file I obtain is a continuous
> >
Stefan Hoorman wrote:
I have performed a series of umbrella sampling simulations in order to
do a WHAM analysis. The profile.xvg file I obtain is a continuous
descending line along my distance axis. There is no increase in energy
after my two structures separate. Perhaps I am doing something
I have performed a series of umbrella sampling simulations in order to do a
WHAM analysis. The profile.xvg file I obtain is a continuous descending line
along my distance axis. There is no increase in energy after my two
structures separate. Perhaps I am doing something wrong.
Thank you
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