Re: [AMBER] Regarding standard deviation and SEM in hbond analysis

From: Rajarshi Roy <phd1701171011.iiti.ac.in>
Date: Tue, 17 Aug 2021 16:28:04 +0530

Ok Sir, Thank you

On Tue, Aug 17, 2021 at 12:40 AM Daniel Roe <daniel.r.roe.gmail.com> wrote:

> Hi,
>
> Adding standard deviation to hbond distance/angle is on my to-do list
> (https://github.com/Amber-MD/cpptraj/issues/392). I will try my best
> to get to it soon, but I can't make any promises on exact timelines...
>
> -Dan
>
> On Mon, Aug 16, 2021 at 4:10 AM Rajarshi Roy <phd1701171011.iiti.ac.in>
> wrote:
> >
> > Dear AMBER users and development team,
> > I have a quick question regarding the hbond command of cpptraj module. In
> > the output file of hbond analysis, we have the average distance and
> average
> > angle of each and every hbond. Is there any way to print the STD and SEM
> > regarding the same parameters?
> > I really appreciate any help if you can provide.
> >
> > --
> > *with regards*
> >
> > *Rajarshi Roy*
> >
> >
> > *PhD Research Scholar*
> >
> > *Biosciences and Biomedical Engineering*
> >
> > *Indian Institute of Technology, Indore*
> > *India*
> > _______________________________________________
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> > http://lists.ambermd.org/mailman/listinfo/amber
>
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>


-- 
*with regards*
*Rajarshi Roy*
*PhD Research Scholar*
*Biosciences and Biomedical Engineering*
*Indian Institute of Technology, Indore*
*India*
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Received on Tue Aug 17 2021 - 04:00:02 PDT
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