Re: [gmx-users] Deleting a folder

[Justin Lemkul]

On 2/27/18 10:09 PM, Ali Ahmed wrote:

Hi Justin,
Thanks for your answer. So, how can I update a code in GROMACS?


Modify, compile, install.

-Justin

--
==

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

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

jalem...@vt.edu | (540) 231-3129
http://www.biochem.vt.edu/people/faculty/JustinLemkul.html

==

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Re: [gmx-users] Deleting a folder

[Ali Ahmed]

Hi Justin,
Thanks for your answer. So, how can I update a code in GROMACS?
Best
Ali

On Tue, Feb 27, 2018 at 5:25 PM, Justin Lemkul  wrote:

>
>
> On 2/27/18 6:23 PM, Ali Ahmed wrote:
>
>> Hello GROMACS users,
>>
>> I'm sorry for the crazy things I did.
>> I was trying to update electric filed code for magnetic filed
>> implementation by adding the cross product term to the force calculation
>> equation. unfortunately, I failed and deleted the mdlib folder (GROMACS
>> 5.1.2).
>> The surprising thing is that GROMAS still applies electric filed.
>> My question is, how does GROMACS apply electric field while the code is
>> deleted?
>>
>
> Deleting source code has no effect on software that's already installed.
> If you try to install again, then your compilation would fail due to
> missing files.
>
> -Justin
>
> --
> ==
>
> Justin A. Lemkul, Ph.D.
> Assistant Professor
> Virginia Tech Department of Biochemistry
>
> 303 Engel Hall
> 340 West Campus Dr.
> Blacksburg, VA 24061
>
> jalem...@vt.edu | (540) 231-3129
> http://www.biochem.vt.edu/people/faculty/JustinLemkul.html
>
> ==
>
> --
> Gromacs Users mailing list
>
> * Please search the archive at http://www.gromacs.org/Support
> /Mailing_Lists/GMX-Users_List before posting!
>
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Re: [gmx-users] Deleting a folder

[Justin Lemkul]

On 2/27/18 6:23 PM, Ali Ahmed wrote:

Hello GROMACS users,

I'm sorry for the crazy things I did.
I was trying to update electric filed code for magnetic filed
implementation by adding the cross product term to the force calculation
equation. unfortunately, I failed and deleted the mdlib folder (GROMACS
5.1.2).
The surprising thing is that GROMAS still applies electric filed.
My question is, how does GROMACS apply electric field while the code is
deleted?


Deleting source code has no effect on software that's already installed. 
If you try to install again, then your compilation would fail due to 
missing files.


-Justin

--
==

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

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

jalem...@vt.edu | (540) 231-3129
http://www.biochem.vt.edu/people/faculty/JustinLemkul.html

==

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[gmx-users] Deleting a folder

[Ali Ahmed]

Hello GROMACS users,

I'm sorry for the crazy things I did.
I was trying to update electric filed code for magnetic filed
implementation by adding the cross product term to the force calculation
equation. unfortunately, I failed and deleted the mdlib folder (GROMACS
5.1.2).
The surprising thing is that GROMAS still applies electric filed.
My question is, how does GROMACS apply electric field while the code is
deleted?

Best
Ali
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