Fw: [gmx-users] trjconv in martini

mohammad agha mra_bu at yahoo.com
Sat Dec 31 10:25:10 CET 2011


Hi Tsjerk,

Thanks for your reply, yas, I did this too!

Best Regards
Sara



________________________________
 From: Tsjerk Wassenaar <tsjerkw at gmail.com>
To: mohammad agha <mra_bu at yahoo.com>; Discussion list for GROMACS users <gmx-users at gromacs.org> 
Sent: Saturday, December 31, 2011 11:42 AM
Subject: Re: Fw: [gmx-users] trjconv in martini
 
Hi Sara,

Please find the script as attachment. When saved, you have to make it
executable using

chmod +x xtcrev.py

Then it should work...

Cheers,

Tsjerk

On Sat, Dec 31, 2011 at 5:59 AM, mohammad agha <mra_bu at yahoo.com> wrote:
> Hi Tsjerk,
>
> Thank you for your reply, yes it is #!/usr/bin/env python
> May I ask you to help me?
>
> Best Regards
> Sara
>
> ________________________________
> From: Tsjerk Wassenaar <tsjerkw at gmail.com>
> To: mohammad agha <mra_bu at yahoo.com>; Discussion list for GROMACS users
> <gmx-users at gromacs.org>
> Sent: Friday, December 30, 2011 8:06 PM
> Subject: Re: Fw: [gmx-users] trjconv in martini
>
> Hi Sara,
> Make sure the first line of the script is:
> #!/usr/bin/env python
> Cheers,
> Tsjerk
>
> On Dec 30, 2011 1:25 PM, "mohammad agha" <mra_bu at yahoo.com> wrote:
>
> ----- Forwarded Message ----- From: mohammad agha <mra_bu at yahoo.com> To:
> Tsjerk Wassenaar <tsjerkw at ...
>
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-- 
Tsjerk A. Wassenaar, Ph.D.

post-doctoral researcher
Molecular Dynamics Group
* Groningen Institute for Biomolecular Research and Biotechnology
* Zernike Institute for Advanced Materials
University of Groningen
The Netherlands
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