ADL: Molecular modelling PC specs

Ragothaman Yennamalli ragothaman at gmail.com
Sun Apr 19 09:55:23 PDT 2020


Look up Tyrone systems for gpu based workstations. They have good systems
with decent specs for the purpose you are looking for.

On Sun, Apr 19, 2020, 9:52 PM Colombano, Alessandro <
alessandro.colombano at abdn.ac.uk> wrote:

> Good Afternoon,
>
> My name is Alessandro and I'm a new research fellow at the University of
> Aberdeen.
>
> My group would like to build molecular modelling expertise towards drug
> discovery of peptides disrupting  protein-protein interactions.
>
> Would anyone be able to recommend decent PC specs (CPU, GPU, RAM type (DDR
> and clock perphaps?) for a linux based modelling station? Or do you known a
> manufacturer dealing with PCs for this purpose?
> Our budget is up to £4000 and we envision to run Autodock, Chimera and
> some molecular dynamics simulations as well.
>
> Any help or additional resources would be extremely helpful!
>
>
>
> Kind regards,
> Alessandro Colombano
>
>
>
>
>
>
>
>
>
> [cid:image001.jpg at 01D6166E.D180EF70]
> Alessandro Colombano, MRSC
> Research Fellow
> Institute of Medical Sciences
> University of Aberdeen
> M: +44 7460051164
> A: Foresterhill , Aberdeen, AB25 2ZD
> Office: 6:24
> E: alessandro.colombano at abdn.ac.uk<mailto:alessandro.colombano at abdn.ac.uk>
> [twitter]<https://twitter.com/AleColombano>[linkedin]<
> https://www.linkedin.com/in/alessandrocolombano/>
>
>
>
>
> The University of Aberdeen is a charity registered in Scotland, No
> SC013683.
> Tha Oilthigh Obar Dheathain na charthannas clàraichte ann an Alba, Àir.
> SC013683.
> ________________________________________________
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