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ms2pip
MS²PIP: Fast and accurate peptide spectrum prediction for multiple fragmentation methods, instruments, and labeling techniques.
https://ms2pip.readthedocs.io
Apache License 2.0
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Remove C models
#214
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RalfG
opened
9 months ago
RalfG
commented
9 months ago
Replace remaining C model files with .xgboost models
Use more accurate mass values
Fix various C compile-time warnings
Format C and Cython code
Fix calculating correlations if some peptides could not be processed (e.g., invalid amino acids). Now returns nan for those spectrum correlations
Clean up setup.py