Update of most similar spectrum script

statisticalbiotechnology / representative-spectra-benchmark

Analysis of different consensus spectrum construction methods

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Update of most similar spectrum script #12

Closed enetz closed 4 years ago

enetz commented 4 years ago

.py and jupyter notebook versions

Input is now and MGF file with all clustered spectra (assumes each cluster is a block in the MGF file) Output is an MGF file with one spectrum per cluster, in the same order as the clusters in the input file