DYANA

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DYANA is program for NMR structure calculation. It is based on a highly efficient implementation of torsion angle dynamics, that is, molecular dynamics simulation torsion angle space. It is the successor of [[DIANA]], my first program package for NMR structure calculation.   
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DYANA is program for NMR structure calculation. It is based on a highly efficient implementation of torsion angle dynamics, that is, molecular dynamics simulation torsion angle space. It is the successor of [[DIANA]], the first program package for NMR structure calculation developed by P. Güntert.   
 
   
 
   
 
== Availability ==
 
== Availability ==
 
 
*  
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*DYANA is no longer available or supported. Its functionality has been incoporated into the program package [http://www.cyana.org/ CYANA].
  
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== Documentation ==
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* [[Media:DyanaManual.pdf|Manual (PDF)]]
  
 
== References ==
 
== References ==
  
* Güntert, P., Mumenthaler, C. & Wüthrich, K. Torsion angle dynamics for NMR structure calculation with the new program DYANA. [http://www.sciencedirect.com/science?_ob=ArticleURL&_udi=B6WK7-45N4X66-4D&_user=3846826&_coverDate=10%2F17%2F1997&_alid=924973130&_rdoc=7&_fmt=high&_orig=search&_cdi=6899&_docanchor=&view=c&_ct=14&_acct=C000061542&_version=1&_urlVersion=0&_userid=3846826&md5=7f249ca034bf882a8589298497992aba J. Mol. Biol. 273, 283-298 (1997)]   
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* Güntert, P., Mumenthaler, C. & Wüthrich, K. Torsion angle dynamics for NMR structure calculation with the new program DYANA[http://www.bpc.uni-frankfurt.de/guentert/Intranet/Reprints/Guntert97b.pdf .] [http://dx.doi.org/10.1006/jmbi.1997.1284 J. Mol. Biol. 273, 283–298 (1997)]
:Any reports or publications of results obtained with DYANA must must cite this paper.
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* Güntert, P. Structure calculation of biological macromolecules from NMR data[http://www.bpc.uni-frankfurt.de/guentert/Intranet/Reprints/Guntert98a.pdf .] [http://journals.cambridge.org/action/displayAbstract?aid=26555 Q. Rev. Biophys. 31, 145–237 (1998)]
* Güntert, P. Structure calculation of biological macromolecules from NMR data. [http://journals.cambridge.org/action/displayAbstract?fromPage=online&aid=26555 Q. Rev. Biophys. 31, 145-237 (1998)]
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Latest revision as of 15:39, 27 November 2009

Dynamics algorithm for NMR applications


DYANA is program for NMR structure calculation. It is based on a highly efficient implementation of torsion angle dynamics, that is, molecular dynamics simulation torsion angle space. It is the successor of DIANA, the first program package for NMR structure calculation developed by P. Güntert.

Availability

  • DYANA is no longer available or supported. Its functionality has been incoporated into the program package CYANA.

Documentation

References

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