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HMDB? #18

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sdrogers opened this issue Oct 11, 2019 · 4 comments

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@sdrogers
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commented Oct 11, 2019

Could we integrate with HMDB?
@mwang87

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commented Oct 11, 2019

Actually HMDB spectra are actually in massbank, so if we just translate between, then we should be good.

Worth putting into next release?
@mwang87

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commented Oct 11, 2019

Actually, an issue is that there might be multiple spectra, so its an ambiguous identifier since it references a structure rather than an experimental observation of it.
@schymane

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commented Oct 11, 2019

There should be a unique spectral identifier available for HMDB spectra, as there are many spectra per HMDB structural identifier.
@schymane

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commented Oct 11, 2019

And yes, they should be in MoNA with their native IDs ... iirc
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@sdrogers @mwang87 @schymane
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