Hi
You can try using nativecontacts in cpptraj. See page 698 in the AMBER
manual for details on how to use this
Best Regards
Elvis
On Mon, 7 Sep 2020 at 10:58, Saikat Pal <saikatpaliitg.yahoo.com> wrote:
> Dear all,
> I want to calculate the number of atoms within a specific radius with time
> progression. Is it possible in cpptraj? I have found a previous mail Re:
> [AMBER] finding number of atoms within a radius from Elvis Martis on
> 2017-05-24 (Amber Archive May 2017)
>
> |
> |
> | |
> Re: [AMBER] finding number of atoms within a radius from Elvis Martis o...
>
>
> |
>
> |
>
> |
>
> where rdf calculation is suggested but I don't want to calculate rdf. Is
> there any way to solve this issue?
>
> Thanks and Regards,
> Saikat Pal
>
>
>
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Received on Mon Sep 07 2020 - 00:30:02 PDT
