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GuentertWiki (talk | contribs) Created page with "''Artificial intelligence for NMR applications'' ATNOS is a software for automated NOESY peak picking and NOE signal identification in homonuclear 2D and heteronuclear-resolved 3D [<sup>1</sup>H,<sup>1</sup>H]-NOESY spectra during de novo protein structure determination by NMR. By incorporating the analysis of the raw NMR data into the process of automated de novo protein structure determination, ATNOS enables direct feedback between the protein structure, the NOE assi..." |
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* Klukowski, P., Riek, R. & Güntert, P. Rapid protein assignments and structures from raw NMR spectra with the deep learning technique ARTINA[https://uni-frankfurt.guentert.science/Reprints/Klukowski22-ARTINA.pdf .] [http://doi.org/10.1038/s41467-022-33879-5 Nat. Commun. 13, 6151 (2022)] | * Klukowski, P., Riek, R. & Güntert, P. Rapid protein assignments and structures from raw NMR spectra with the deep learning technique ARTINA[https://uni-frankfurt.guentert.science/Reprints/Klukowski22-ARTINA.pdf .] [http://doi.org/10.1038/s41467-022-33879-5 Nat. Commun. 13, 6151 (2022)] | ||
* Klukowski, P., Riek, R. & Güntert, P. NMRtist: an online platform for automated biomolecular NMR spectra analysis[https://uni-frankfurt.guentert.science/Reprints/Klukowski23-NMRtist.pdf .] [http://doi.org/10.1093/bioinformatics/btad066 Bioinformatics 39, btad066 (2023)] | |||
* Klukowski, P., Riek, R. & Güntert, P. Time-optimized protein NMR assignment with an integrative deep learning approach using AlphaFold and chemical shift prediction[https://uni-frankfurt.guentert.science/Reprints/Klukowski23-ARTINAAlphaFold.pdf .] [http://doi.org/10.1126/sciadv.adi9323 Sci. Adv. 9, eadi9323 (2023)] | |||
Revision as of 11:07, 25 January 2026
Artificial intelligence for NMR applications
ATNOS is a software for automated NOESY peak picking and NOE signal identification in homonuclear 2D and heteronuclear-resolved 3D [1H,1H]-NOESY spectra during de novo protein structure determination by NMR. By incorporating the analysis of the raw NMR data into the process of automated de novo protein structure determination, ATNOS enables direct feedback between the protein structure, the NOE assignments and the experimental NOESY spectra.
Availability
- ARTINA is available in the NMRtist web platform.
References
- Klukowski, P., Riek, R. & Güntert, P. Rapid protein assignments and structures from raw NMR spectra with the deep learning technique ARTINA. Nat. Commun. 13, 6151 (2022)
- Klukowski, P., Riek, R. & Güntert, P. NMRtist: an online platform for automated biomolecular NMR spectra analysis. Bioinformatics 39, btad066 (2023)
- Klukowski, P., Riek, R. & Güntert, P. Time-optimized protein NMR assignment with an integrative deep learning approach using AlphaFold and chemical shift prediction. Sci. Adv. 9, eadi9323 (2023)