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taxonomicallyinformedannotation / tima

https://taxonomicallyinformedannotation.github.io/tima
https://taxonomicallyinformedannotation.github.io/tima/
GNU General Public License v3.0
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[external spectral libraries] add Massbank #77

Closed Adafede closed 1 year ago

Adafede commented 1 year ago

Is your feature request related to a problem? Please describe. As a user, I would like to be able to match my spectra against Massbank library(ies?).

Describe the solution you'd like A simple step performing spectral matching against Massbank as already implemented for CFM-ID in silico libraries

Describe alternatives you've considered Using RMassbank

Additional context Look at https://zenodo.org/record/8014263 Eventually ask @meowcat for guidance See how well it is linked to https://gnps-external.ucsd.edu/gnpslibrary and which option is better

Adafede commented 1 year ago

See https://github.com/MassBank/MassBank-data/issues/238

Adafede commented 1 year ago

See 06a0ff4d47bd5ede726c615006aa095de05c267b