BamoRC: A software package for accurate and robust 13C reference correction of protein NMR spectra

Xi Chen; Andrey Smelter; Hunter N.B. Moseley

doi:10.1177/1934578X19849142

BamoRC: A software package for accurate and robust ¹³C reference correction of protein NMR spectra

Xi Chen
, Andrey Smelter
, Hunter N.B. Moseley

Producción científica: Article › revisión exhaustiva

Resumen

We describe Bayesian Model Optimized Reference Correction (BaMORC), a software package that performs ¹³C chemical shifts reference correction for either assigned or unassigned peak lists derived from protein NMR spectra. BaMORC provides an intuitive command line interface that allows non-nuclear magnetic resonance (NMR) experts to detect and correct ¹³C chemical shift referencing errors of unassigned peak lists at the very beginning of NMR data analysis, further lowering the bar of expertise required for effective protein NMR analysis. Furthermore, BaMORC provides an application programming interface for integration into sophisticated protein NMR data analysis pipelines, both before and after the protein resonance assignment step.

Idioma original	English
Publicación	Natural Product Communications
Volumen	14
N.º	5
DOI	https://doi.org/10.1177/1934578X19849142
Estado	Published - may 2019

Nota bibliográfica

Publisher Copyright:
© The Author(s) 2019

Financiación

The authors acknowledge support from the National Science Foundation grant and National Institutes of Health grants. with respect to the research, authorship, and/or publication of this article: Support for this research was provided by the National Science Foundation grant NSF 1419282 (Hunter N.B. Moseley) and National Institutes of Health grants NIH UL1TR001998-01 (Philip Kern) and NIH P30CA177558 (Mark Evers). The author(s) declared the following potential conflicts of interest with respect to the research, authorship, and/or publication of this article: Support for this research was provided by the National Science Foundation grant NSF 1419282 (Hunter N.B. Moseley) and National Institutes of Health grants NIH UL1TR001998-01 (Philip Kern) and NIH P30CA177558 (Mark Evers).

Financiadores	Número del financiador
National Science Foundation (NSF)	NSF 1419282
National Institutes of Health (NIH)	P30CA177558, UL1TR001998-01
National Science Foundation (NSF)	1419282

ASJC Scopus subject areas

Drug Discovery
Complementary and alternative medicine
Plant Science
Pharmacology

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