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nmr_bmrb-chemical-shifts

A visualization tool for the Biological Magnetic Resonance Databank (BMRB) chemical shift statistics.

The filtered data set1 for standard amino acids is fetched and then interactive Bokeh charts are generated for each nucleus:

Black vertical lines indicate the mean chemical shift for each atom, while the colored horizontal bars show ± one standard deviation range.

All charts can be panned and zoomed (also the individual axes). Hover over each bar to see the corresponding data:

  • Amino acid type
  • Atom type
  • Chemical shift stats
    • Average
    • Standard deviation
    • Minimum
    • Maximum

1 Only chemical shifts from standard amino acids in diamagnetic samples.


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A visualization tool for the BMRB chemical shift statistics

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