Hi all,
I want to buy a laptop suitable and powerful enough for MD simulations
with GROMACS (mostly membrane/protein systems). Could you recommend
optimal features for this goal?
Thanks
Yasser
--
Yasser Almeida Hernández
PhD student
Institute of Biochemistry and Molecular Biology
Department
Dear Yasser,
I am by no means an expert on hardware, but I would strongly advise against
buying a laptop for the specific purpose of running (any and all) MD
simulations. A desktop is much better suited platform for such a task, as
you should be able to get a much bigger bang for your buck (this i
calculations. My question was to get some thoughts about an
ideal/optimal hardware.
Best
Yasser
Message: 6
Date: Wed, 3 Feb 2016 10:53:31 +0100
From: Jo?o Henriques
To: Discussion list for GROMACS users
Subject: Re: [gmx-users] Laptop features for MD simulations
100
> From: Jo?o Henriques
> To: Discussion list for GROMACS users
> Subject: Re: [gmx-users] Laptop features for MD simulations -
> recommendations
> Message-ID:
> <
> calc+hgt7zsmbkwitu11dprvh4m_qyw2btkgnsq2tvb70o71...@mail.gmail.com>
> Content-Type:
to get some thoughts about an ideal/optimal hardware.
Best
Yasser
Message: 6
Date: Wed, 3 Feb 2016 10:53:31 +0100
From: Jo?o Henriques
To: Discussion list for GROMACS users
Subject: Re: [gmx-users] Laptop features for MD simulations -
recommendations
Messa
e/work purpose,
>> but I would like to have a device robust enough to run calculations. My
>> question was to get some thoughts about an ideal/optimal hardware.
>>
>> Best
>>
>> Yasser
>>
>> ----
>> Message
;> want
> >> to buy is not just for simulations, but for general private/work
> purpose,
> >> but I would like to have a device robust enough to run calculations. My
> >> question was to get some thoughts about an ideal/optimal hardware.
> >>
> >> Be
like to have a device robust enough to run calculations. My question
> was to get some thoughts about an ideal/optimal hardware.
>
> Best
>
> Yasser
>
>
> Message: 6
> Date: Wed, 3 Feb 2016 10:53:31 +0100
> From: Jo?o Henriques
> To: Discu
t;>
>> Best
>>
>> Yasser
>>
>> ----
>> Message: 6
>> Date: Wed, 3 Feb 2016 10:53:31 +0100
>> From: Jo?o Henriques
>> To: Discussion list for GROMACS users
>> Subject: Re: [gmx-users] Laptop features for MD sim
ork purpose, but I
>>> would like to have a device robust enough to run calculations. My question
>>> was to get some thoughts about an ideal/optimal hardware.
>>>
>>> Best
>>>
>>> Yasser
>>>
>>>
>>>
s. I
> >>> do my runs in workstations designed for that purpose. The hardware I
> want to
> >>> buy is not just for simulations, but for general private/work purpose,
> but I
> >>> would like to have a device robust enough to run calculations. My
> question
>
Hi all,
I want to buy a laptop suitable and powerful enough for MD simulations
with GROMACS (mostly membrane/protein systems). Could you recommend
optimal features for this goal?
Thanks
Yasser
Hi Yasser,
just an extension to the previous answers. In case, money is not the
problem, I can p
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