Thank you very much Justin. It is good now.
Best,Mohammad
From: Justin Lemkul <jalem...@vt.edu>
To: gmx-us...@gromacs.org
Sent: Monday, 29 May 2017, 23:40:06
Subject: Re: [gmx-users] Genion error
On 5/29/17 4:35 AM, Mohammad Roostaie wrote:
> Thank you Justin. Here is the link to access the topology
> file:https://www.dropbox.com/sh/x58tzpmg0vzkbtg/AADH_efF_s8jKx4OaHN8a7IPa?dl=0
>
> By the way, I do not know about your advice. Can you please give me the link?
It's somewhere in the archive. Run the topology through dos2unix and always
make sure to use a plain text editor. See if that works.
-Justin
> Kind regards,Mohammad
>
> From: Justin Lemkul <jalem...@vt.edu>
> To: gmx-us...@gromacs.org
> Sent: Monday, 29 May 2017, 0:21:10
> Subject: Re: [gmx-users] Genion error
>
>
>
> On 5/28/17 3:43 AM, Mohammad Roostaie wrote:
>> Hi All, when I wanted to add ions to the system, I got this error:
>> Fatal error:No line with moleculetype 'SOL' found the [ molecules ] section
>> of file 'gr.top'For more information and tips for troubleshooting, please
>> check the GROMACSwebsite at http://www.gromacs.org/Documentation/Errors
>> However, there is 'SOL' molecule type in the [ molecules ] section of the
>> topology file. Can you please help me to solve this problem?
>
> Upload your topology to a file-sharing service and provide the URL to access
> it.
> There's no way to know what's going on (and I recall giving some previous
> advice about line endings - have you checked this?)
>
> -Justin
>
--
==================================================
Justin A. Lemkul, Ph.D.
Ruth L. Kirschstein NRSA Postdoctoral Fellow
Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 629
University of Maryland, Baltimore
20 Penn St.
Baltimore, MD 21201
jalem...@outerbanks.umaryland.edu | (410) 706-7441
http://mackerell.umaryland.edu/~jalemkul
==================================================
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