Re: [AMBER] Using plumed with amber

From: David A Case via AMBER <>
Date: Wed, 28 Jun 2023 08:22:57 -0400

On Wed, Jun 28, 2023, Songyan Xia (LHS, 118010341) via AMBER wrote:

>      I want to use plumed with amber to do some CV
>calculations, I noticed that when compiling amber, amber describes plumed
>as "used as an alternate MD backend for Sander", is this means that plumed
>can only used with sander but not pmemd to do the MD simulation?

Plumed is available in pmemd as well. But it runs on the CPU (I believe)
and can therefore slow down GPU-based (pmemd.cuda) simulations.


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Received on Wed Jun 28 2023 - 05:30:06 PDT
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