bachi55/massbank2db

Issues

• Add the github workflow to run the unittests automatically

  #15 opened 3 years ago by bachi55
  1

• Test without PubChem Update

  #18 opened 4 years ago by bachi55
  0

• Allow building a database without tandem mass spectra (MS2)

  #17 opened 4 years ago by bachi55
  0

• Test the library on the latest MassBank release

  #16 opened 4 years ago by bachi55
  0

• Implement filter for early eluting molecules

  #14 opened 4 years ago by bachi55
  0

• Add function to output the MBSpectrum as MetFrag or CSI:FingerID input

  #4 opened 4 years ago by bachi55
  2

• Move MassbankDB class parameters to the dataset insertion function

  #1 opened 4 years ago by bachi55
  1

• Generate new accession title when spectra merging

  #6 opened 4 years ago by bachi55
  1

• Return merge spectra

  #2 opened 4 years ago by bachi55
  0