[gmx-users] Re: access code for qmmm (Farzad Molani)

Gerrit Groenhof ggroenh at gwdg.de
Tue Nov 17 11:26:50 CET 2009


Yesterday Ilona has already given the information for you to formulate  
a new question. So be more specific about what problem you have now.

Best,

Gerrit


>
> Today's Topics:
>
>   6. Re: access code for qmmm (Farzad Molani)
>   7. RE: access code for qmmm (Kukol, Andreas)
>   8. Urea Topology (karan syal)
>
> Message: 6
> Date: Tue, 17 Nov 2009 00:56:31 -0800 (PST)
> From: Farzad Molani <farzad_c81 at yahoo.com>
> Subject: Re: [gmx-users] access code for qmmm
> To: Discussion list for GROMACS users <gmx-users at gromacs.org>
> Message-ID: <843559.85861.qm at web55703.mail.re3.yahoo.com>
> Content-Type: text/plain; charset="us-ascii"
>
> Hello,
> Have you ever done QM/MM? please introduce a free and good package  
> for academic user.
> Thanks in advance
>
> Farzad Molani,
> Ph.D Student,
> Department of Theoretical Chemistry and Biochemistry,
> K. N. Toosi University of Technology,
> Tehran, Iran.
> Tel.: 009821 2306 4280
> Fax: 009821 2285 3650
> Web: http://www.kntu.ac.ir
>
>
>
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>
> ------------------------------
>
> Message: 7
> Date: Tue, 17 Nov 2009 09:37:28 +0000
> From: "Kukol, Andreas" <a.kukol at herts.ac.uk>
> Subject: RE: [gmx-users] access code for qmmm
> To: Discussion list for GROMACS users <gmx-users at gromacs.org>
> Message-ID:
> 	<2F848DC922C8D741BF3A60B7D7108B6A82EECB52BE at UH-MAILSTOR.herts.ac.uk>
> Content-Type: text/plain; charset="us-ascii"
>
> GROMACS can do QM/MM.
>
> Andreas
>
> -----------------------
>
> From: gmx-users-bounces at gromacs.org [mailto:gmx-users-bounces at gromacs.org 
> ] On Behalf Of Farzad Molani
> Sent: 17 November 2009 08:57
> To: Discussion list for GROMACS users
> Subject: Re: [gmx-users] access code for qmmm
>
> Hello,
> Have you ever done QM/MM? please introduce a free and good package  
> for academic user.
> Thanks in advance
>
> Farzad Molani,
> Ph.D Student,
> Department of Theoretical Chemistry and Biochemistry,
> K. N. Toosi University of Technology,
> Tehran, Iran.
> Tel.: 009821 2306 4280
> Fax: 009821 2285 3650
> Web: http://www.kntu.ac.ir
>
>
>
> ------------------------------

--
Gerrit Groenhof
MPI biophysical chemistry
Goettingen
Germany
http://wwwuser.gwdg.de/~ggroenh/




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