[gmx-users] gmx not found

Justin Lemkul jalemkul at vt.edu
Sun Apr 22 22:17:25 CEST 2018



On 4/22/18 4:15 PM, Tina Huang wrote:
> Hi Justin,
>
> Actually I think it’s cause I installed gromacs 4 but gmx is gromacs 5
> command. Do you know what is the equivalent of gmx for gromacs 4?

There is no "gmx" in any version prior to 5.0, each program is its own 
entity.

I strongly advise against installing such outdated software. We don't 
officially support anything in the 4.x series any more (and we're not 
inclined to provide help for outdated software, and tutorials are no 
longer available for it). Please take advantage of feature enhancements, 
bug fixes, and increased speed and work with the latest version, 2018.1.

-Justin

> Thanks a lot!
> Tina
>
> On Sun, Apr 22, 2018 at 4:05 PM Tina Huang <yutinghuang01 at g.harvard.edu>
> wrote:
>
>> Thanks Justin! I’ll try it!
>>
>> Best,
>> Tina
>>
>> On Sun, Apr 22, 2018 at 4:04 PM Justin Lemkul <jalemkul at vt.edu> wrote:
>>
>>>
>>> On 4/22/18 3:04 PM, Huang, Tina wrote:
>>>> Hi Everyone,
>>>>
>>>> I installed gromacs4 on the remote linux machine.  And it shows gmx
>>>> not found right now. Can someone help me please? :)
>>>
>>> http://manual.gromacs.org/documentation/current/install-guide/index.html#getting-access-to-gromacs-after-installation
>>>
>>> -Justin
>>>
>>> --
>>> ==================================================
>>>
>>> Justin A. Lemkul, Ph.D.
>>> Assistant Professor
>>> Virginia Tech Department of Biochemistry
>>>
>>> 303 Engel Hall
>>> 340 West Campus Dr.
>>> Blacksburg, VA 24061
>>>
>>> jalemkul at vt.edu | (540) 231-3129
>>> http://www.thelemkullab.com
>>>
>>> ==================================================
>>>
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-- 
==================================================

Justin A. Lemkul, Ph.D.
Assistant Professor
Virginia Tech Department of Biochemistry

303 Engel Hall
340 West Campus Dr.
Blacksburg, VA 24061

jalemkul at vt.edu | (540) 231-3129
http://www.thelemkullab.com

==================================================



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