What do you mean by reweight?
On Sun, Dec 3, 2023, 6:30 AM Dulal Mondal via AMBER <amber.ambermd.org>
wrote:
> please any help. How do I reweight the trajectory file?
> ---------- Forwarded message ---------
> From: Dulal Mondal <babunmondal.chem.kgpian.iitkgp.ac.in>
> Date: Fri, Dec 1, 2023 at 12:41 AM
> Subject: Re weighting trajectory file
> To: AMBER Mailing List <amber.ambermd.org>
>
>
> Dear Experts,
>
> I run constant pH remd simulation. Then, I generate trajectory files for
> all pH. But I am trying to reweight the trajectory file. How can I reweight
> the trajectory file?
>
> Thanking You
> With regard
> Dulal Mondal
>
>
> --
> *With regards,*
> *Dulal Mondal,*
> *Research Scholar,*
> *Department of Chemistry,*
> *IIT Kharagpur, Kharagpur 721302.*
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Received on Sun Dec 03 2023 - 04:00:03 PST
