MassBank / MassBank-data

Official repository of open data MassBank records
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added MSSJ records. #256

Closed satstnka closed 2 months ago

meier-rene commented 2 months ago

Thank you for your contribution. There were a small number of issues with the SMILES and InChI. Sometimes the InChI was for a isomer and the SMILES was lacking this information. The validator marked this entries with an error. I fixed them.