[gmx-users] Re: Minimization before NMA

[Vitaly Chaban]

nahren:

Hmm... Why do you think Fmax=1.754e+00 is  not enough for NMA?

Dr. Vitaly Chaban


> I am unable to minimize a complex protein (Trimer-Trimer complex) to even less than Fmax=1.754e+00.
>
> I tried few tricks like performing MD for few steps etc, but it does not yield any results.
>
> I am sure there must be a way out. Can you please advice.
>
> Thanks for your attention.
>
> nahren
>