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simpson-simmol · The SIMPSON - SIMMOL Discussion Forum

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Group Information

  • Members: 363
  • Category: Chemistry
  • Founded: Dec 10, 2001
  • Language: English
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Description

SIMPSON and SIMMOL are software packages for simulation of multi-spin and multi-dimensional NMR experiments and for specification and visualization of anisotropic spin interactions in biomolecular NMR.

This SIMPSON - SIMMOL Discussion Forum is the place where users can exchange ideas, ask questions, and where information on new releases of SIMPSON and SIMMOL will be provided.

(I have changed the membership policy from open to restricted such that new members should be approved before posting emails. This is to prevent the increasing amount of spam mails that have been posted in the group recently.

To become a member you just have to sign in and explain very briefly your interest in NMR and SIMPSON/SIMMOL... I hope this will prevent new spam members from signing in.)

Most Recent Messages

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problem in installing simmol
Now I am trying to solve a problem, which need the use of both SIMPSON and SIMMOL. I have successfully installed SIMPSON. But I am finding problem in
Posted - Fri May 3, 2013 8:45 am
Paul
shubhajit.paul
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Simulation of 35/37Cl coupling to 195Pt nucleus
Good day all, I hope all is well; I am a PhD student at Stellenbosch University, South Africa. I have been doing 195Pt CP/MAS SSNMR measurements on (NH4)2PtCl6
Posted - Mon Apr 22, 2013 12:22 pm
james_odendal
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Re: Segmentation fault with gcompute
Dear Zednek, There was a mistake in my previous post (i used the flag -NSOpen=exp-1.in), the current output of gdb is as follows, (gdb) run exp-1.in Starting
Posted - Sat Nov 24, 2012 8:22 pm
janarthanan_k2004
janarthanan_...
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Re: Segmentation fault with gcompute
Dear Zdenek, Thanks for your kind suggestion. I get this segmentation fault only with the binary compiled in my system (Ubuntu 11.10, oneiric; gcc version
Posted - Sat Nov 24, 2012 6:36 pm
janarthanan_k2004
janarthanan_...
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Re: Segmentation fault with gcompute
That is very strange. You say you get segfault every time you use gcompute? And only when you compile by yourself... Can you localize where it crashes using
Posted - Fri Nov 23, 2012 8:00 am
Zdeněk Tošner
ztosner
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Message History

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2001 9

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