Results for “mitre-atlas”
2 skills
k-dense-ai pymatgen
Analyze and manipulate crystal structures, compute phase diagrams, and access the Materials Project database using the pymatgen library.
30.2k · bundle
k-dense-ai matchms
Process and analyze mass spectrometry data: import spectra from MGF, mzML, MSP, and JSON formats; apply 40+ filters for metadata harmonization and peak cleaning; compute spectral similarities (cosine, modified cosine) for compound identification; build reproducible processing pipelines.
30.2k · bundle