AMBER Archive (2003)

Subject: Re: how to restrain water

From: Alfonso Garcia Sosa (atg21_at_hermes.cam.ac.uk)
Date: Mon Jun 23 2003 - 10:42:42 CDT

Oh, and I think also option IVCAP, described in the same section. Cheers

On Mon, 23 Jun 2003, Alfonso Garcia Sosa wrote:

>
> I think you can use the option FCAP, mentioned in section 5.6.13 in the
> amber7 manual.
>
> Alfonso Garcia Sosa
> Dept of Pharmacology & Wolfson College
> University of Cambridge, UK
>
> On Mon, 23 Jun 2003, Mao Xiang wrote:
>
> > Hello, everyone:
> > I wonder how I could setup a harmonic force to
> > waters leaving a certain boundary after solvate the
> > protein using solvatecap. Thanks for your help.
> >
> >
> > Best Regards,
> > Xiang
> >
> > __________________________________
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>