Tools to filter (normalize intensities, filter mz range, convert adducts, ...) and convert (msp/mgf/json) mass spectral libraries and to perform spectral, fingerprint and metadata similarity calculations as well as molecular networking. |
hg clone https://toolshed.g2.bx.psu.edu/repos/recetox/matchms_spectral_similarity
Name | Description | Version | Minimum Galaxy Version |
---|---|---|---|
matchms spectral similarity calculation | 0.24.0+galaxy0 | 21.09 |