Re: [AMBER] Computer for running MD simulation using Amber

From: Marek Havrila <>
Date: Thu, 9 Nov 2017 13:15:15 +0100

Dear Ashok,

MD simulation is a bit too general. If you need to run explicit solvent
molecular dynamics simulation of protein or nucleic acid, use of GPU is
essential. You should better specify what kind of tasks you need to address
in your MD.

Best wishes,

On Thu, Nov 9, 2017 at 12:26 PM, Ashok Kumar <> wrote:

> Dear amber users
> I want to buy computer with linux OS to install amber17 for the MD
> simulation. Please can someone recommend me the best computer (I need
> specification in terms of capacity and speed) suitable for this
> purpose
> _______________________________________________
> AMBER mailing list
AMBER mailing list
Received on Thu Nov 09 2017 - 04:30:03 PST
Custom Search