view test-data/findrecalseries/selected_series.tabular @ 3:1104682fb7cc draft

planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/mfassignr commit c16561e825cd376dec5f5c252dc8743ad1dc2ca4
author recetox
date Mon, 16 Sep 2024 09:06:47 +0000
parents ddb9d330ecc0
children
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"Series"	"total_abundance"	"total_series_length"	"peak_proximity"	"peak_distance_proximity"	"series_id"	"sum_score"
"O_H_7"	437.136255030871	504.562	129.612788237483	2723.59808058946	"O_H_7 O2_H_6 O2_H_11"	3794.90912385781
"O2_H_6"	437.136255030871	504.562	129.612788237483	2723.59808058946	"O_H_7 O2_H_6 O2_H_11"	3794.90912385781
"O2_H_11"	437.136255030871	504.562	129.612788237483	2723.59808058946	"O_H_7 O2_H_6 O2_H_11"	3794.90912385781
"O4_H_11"	943.304144088114	392.438	134.36084248065	1826.47532994759	"O2_H_6 O2_H_11 O4_H_11"	3296.57831651636
"O3_H_12"	330.037060987448	364.407	135.12153276257	1826.47538570915	"O2_H_6 O3_H_12 O2_H_11"	2656.04097945917