Re: [AMBER] Constant pH remd in amber

From: Jason Swails via AMBER <amber.ambermd.org>
Date: Wed, 28 Jun 2023 08:11:09 -0400

No changes should be necessary. Did you try it?

On Thu, Jun 22, 2023 at 10:22 AM Dulal Mondal via AMBER <amber.ambermd.org>
wrote:

> Dear Users,
>
> I have run the cpHMD simulation in the explicit solvent in amber19. Now I
> am trying to run constant pH REMD simulation in the explicit solvent in
> amber22. How can I convert my cpin file, which I have generated using
> amber18?
>
> --
> *With regards,*
> *Dulal Mondal,*
> *Research Scholar,*
> *Department of Chemistry,*
> *IIT Kharagpur, Kharagpur 721302.*
> _______________________________________________
> AMBER mailing list
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>


-- 
Jason M. Swails
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Received on Wed Jun 28 2023 - 05:30:03 PDT
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