[gmx-users] Constant pH replica exchange MD in Gromacs (Muneeswaran S)
Groenhof, Gerrit
ggroenh at gwdg.de
Wed Dec 18 07:58:21 CET 2019
No, but this is possible in Charmm and in Amber.
Best,
Gerrit
> Date: Wed, 18 Dec 2019 11:52:15 +0530
> From: Muneeswaran S <wmunees47 at gmail.com>
> To: gmx-users at gromacs.org
> Subject: [gmx-users] Constant pH replica exchange MD in Gromacs
> Message-ID:
> <CAN=_HbeyT3iepj0N6v-mn89Nng6=aPdmP_+BAopLz5Rc3G894g at mail.gmail.com>
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> Good Morning Friends,
>
> I want to run Constant pH replica exchange MD
> for my peptides. Is that possible with GROMACS?
>
> please let me know. Its urgent.
>
>
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