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Re: Good NMR-software anyone?



Hi Stephan,

I think you have to specify more on which part of the whole NMR measurement process the software should kick in. What does the software need to do:
- the measurement (e.g. gpib read out) ?
- data manupilation ?
- visual representation ?

Greetings Rob





On Fri, 23 Sep 2005 11:34:15 +0200
Stephan Gromer <stephan.gromer@gmx.de> wrote:

> Dear all,
> 
> In our department some folks started to use NMR. They have been
> recommended to use MestReC (currently a Windows-only program 8but see
> end of message), http://www.mestrec.com/mestrec.php). I admit that I am a total
> ignorant when it comes to NMR so "googling" around did not lead very
> far.
> What I found was
> 
> NPNMR:       http://members.aol.com/npnmr/
> NMRPipe:     http://spin.niddk.nih.gov/bax/software/NMRPipe/
> NMRnotebook: http://www.nmrtec.com/GIFA5/
> 
> Does anyone know these programs and can tell me if they are usable
> for NMR analysis (are stable, etc.) and what are their advantages,
> disadvantages?
> My problem is that I can hardly judge the usability of these programs
> myself (as I hardly know anything about NMR as I already mentioned)
> and the people in our group aren't to keen on playing around with many
> programs just for testing ("as MestReC does the job")(and I am not in
> the position to tell THEM to). My current concept is to replace all
> software require with software that is available under Linux also
> (e.g. OOo, Firefox etc.). My folks are not yet converted to Linux so I
> would initially make these special programs available via FreeNX if
> they are "Linux only". Once people get used to it I will switch the
> users completely.
> 
> Thank you for listening!
> Regards,
>  Stephan
> 
> PS:
> I asked the company that codes MestReC if they will provide a Linux
> version, and this is what I was pleased to read:
> >[..]
> > I am pleased to inform you that we are currently working on a
> > multiplatform version of MestReC for Mac & Linux. Since it is not a
> > simple task to carry out, it won't be ready until early 2006 as we
> > want this version to be as complete and as stable as possible. Once
> > the program is ready for release, we will definitely let you know.
> > In the meantime, we do provide a version of MestReC for Linux that
> > can run through a Windows emulator. If you would like to try it,
> > please feel free to let me know.
> >[..]
> 
> -- 
> Stephan Gromer, MD. PhD.
> Work:  Biochemie-Zentrum Heidelberg / Im Neuenheimer Feld 504 / D-69120
>  Heidelberg / Tel.: +49 (6221) 544291 / Fax.: +49 (6221) 545586
> Home:  Sternallee 89 / D-68723 Schwetzingen / Tel.: +49 (6202) 855038
>  Mobil: +49 (172) 7694555 / URL: http://www.gromer-online.de
> 
> 
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