Re: [AMBER] Dear all

From: ankita mehta <mehtaroadies.gmail.com>
Date: Fri, 12 Feb 2016 17:48:58 +0530

NMR distance restraints r ok to apply ?

On Fri, Feb 12, 2016 at 5:42 PM, Bill Ross <ross.cgl.ucsf.edu> wrote:

> NMR distance restraints.
>
> http://ambermd.org/tutorials/advanced/tutorial4/ - looks like you can
> set upper bound in a 7-column file, then process it with makeDIST_RST.
>
> On 2/12/16 4:10 AM, ankita mehta wrote:
> > Can u please send me exact link or page number in manual !
> > Whatever i found that is for NMR restraints..
> > thnks in advance
> >
> > On Fri, Feb 12, 2016 at 5:19 PM, Bill Ross <ross.cgl.ucsf.edu> wrote:
> >
> >> It is described in the manual and probably one or more demos I suspect.
> >>
> >> On 2/12/16 3:40 AM, ankita mehta wrote:
> >>> how it is done ?
> >>>
> >>>
> >>> On Fri, Feb 12, 2016 at 5:06 PM, Bill Ross <ross.cgl.ucsf.edu> wrote:
> >>>
> >>>> You could use weak distance restraints to nearby atoms.
> >>>>
> >>>> Bill
> >>>>
> >>>> On 2/12/16 3:03 AM, ankita mehta wrote:
> >>>>> Dear All,
> >>>>>
> >>>>> I want to minimize a protein which contains Zn ion.
> >>>>> But the problem is Zn ion is displacing from the position after
> >>>>> minimization!
> >>>>> Can u suggest the way through which position of Zn ion can be fixed.
> >>>>> i am attaching t he leap.log file and min.out file..
> >>>>> please suggest the way out!
> >>>>>
> >>>>> I shall be thankful!
> >>>>>
> >>>>>
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Received on Fri Feb 12 2016 - 04:30:05 PST
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