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• W2401285145 abstract "This chapter gives an overview of automated protein structure determination by nuclear magnetic resonance (NMR) with the UNIO protocol that enables high to full automation of all NMR data analysis steps involved. Four established algorithms, namely, the MATCH algorithm for sequence-specific resonance assignment, the ASCAN algorithm for side-chain resonance assignment, the CANDID algorithm for NOE assignment, and the ATNOS algorithm for signal identification in NMR spectra, are assembled into three principal UNIO NMR data analysis components (MATCH, ATNOS/ASCAN, and ATNOS/CANDID) that are accessed thanks to a particularly intuitive and flexible, yet powerful graphical user interface (GUI). UNIO is designed to work independently or in association with other NMR software. The principal data analysis components for sequence-specific backbone, side-chain and NOE assignment may be run separately or out of sequence. User-intervention at individual stages is encouraged and facilitated by graphical tools included for the preparation, analysis, validation, and subsequent presentation of the NMR structure." @default.
• W2401285145 created "2016-06-24" @default.
• W2401285145 creator A5024081162 @default.
• W2401285145 creator A5078934466 @default.
• W2401285145 date "2011-11-18" @default.
• W2401285145 modified "2023-09-28" @default.
• W2401285145 title "Comprehensive Automation for NMR Structure Determination of Proteins" @default.
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• W2401285145 doi "https://doi.org/10.1007/978-1-61779-480-3_22" @default.
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