MassBank-data
MassBank-data copied to clipboard
MassBank
Official repository of open data MassBank records
Suggestion by @egonw to change CC-BY to CC0 by default, as this is the more applicable and most flexible license. Agree?
Copy-paste from email received; @meier-rene are you able to follow-up? Thx! Comparing data from different databases, I found some discrépancies between your data. For the mentioned entry of your database...
There are 10 records having the tag `COMMENT: CONFIDENCE` without any confidence value. I think this should not be valid, so please create a rule for the validator and correct...
With new API and token rules, it will be easier to add ChemSpider IDs to new records on the MassBank-data side rather than via RMassBank. Posting this as a result...
Here are the notes and to does from our webmeeting with @laurentheirendt - make a dev branch - improve contribution guidelines (checkout the dev branch, ...) - push / merge...
Dear all, after implementing an automatic test to check for problems similar to #13 i found a problem with [JEOL_Ltd/JEL00034.txt ](https://massbank.eu/MassBank/RecordDisplay.jsp?id=JEL00034&dsn=JEOL_Ltd) The peak list might contain two different spectra. ```...
I am comparing the MoNA record at http://mona.fiehnlab.ucdavis.edu/spectra/display/BSU00002 with the MassBank record at https://massbank.eu/MassBank/RecordDisplay.jsp?id=BSU00002 I see stereochem in the structure depiction on MoNA but not in the MassBank record. I...
I just stumbled over two records, which seem to be duplicates. Meta data as well as the spectrum is exactly the same. https://massbank.eu/MassBank/RecordDisplay.jsp?id=TY000228&dsn=Univ_Toyama https://massbank.eu/MassBank/RecordDisplay.jsp?id=TY000237&dsn=Univ_Toyama Maybe it is worth to search...
Some "compounds" we measure are not single compounds, but mixtures of isomers or similar compounds. However, often the mixture is reported, for example Nystatin, which contains Nystatin A1, A2 and...