Re: Any alternative to colvars for minimization?

From: Giacomo Fiorin (giacomo.fiorin_at_gmail.com)
Date: Thu Jun 06 2013 - 08:25:34 CDT

The first versions of the colvars module in NAMD didn't support
minimization, but not any more. The one NAMD 2.9 certainly does.

Did you actually try it?

On Thu, Jun 6, 2013 at 1:36 AM, Francesco Pietra <chiendarret_at_gmail.com>wrote:

> Hello:
> May I as whether there is an alternative to (non usable) colvars for
> minimization with namd2.9/parm7? I would like to restrain dihedrals around
> a transition metal in a protein. Once passed the minimization, I could use
> colvars.
>
> Thanks
> francesco pietra
>

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