Mercurial > repos > tomnl > mspurity_puritya

diff test-data/spectralMatching_matched_results.tsv @ 0:1251fc5c058e draft

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planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit 2948ce35fa7fffe5a64711cb30be971031e79019-dirty
author tomnl
date Fri, 24 May 2019 09:11:29 -0400
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children a6f519dff5a8
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--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/spectralMatching_matched_results.tsv	Fri May 24 09:11:29 2019 -0400
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+"pid"	"grpid"	"mz"	"mzmin"	"mzmax"	"rt"	"rtmin"	"rtmax"	"npeaks"	"sample"	"LCMSMS_2"	"LCMSMS_1"	"LCMS_2"	"LCMS_1"	"grp_name"	"dpc"	"rdpc"	"cdpc"	"mcount"	"allcount"	"mpercent"	"accession"	"name"	"inchikey"	"lpid"	"mid"
+1664	14	113.035283604395	113.035156497997	113.03541992282	80.50932	77.16429	83.64567	4	4	88462324.9597518	92812020.095242	77298864.2688328	77198465.9156761	"M113T81"	0.942265459948335	0.996860823822942	0.753812367958668	1	4	0.25	"PR100037"	"Uracil; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+"	"ISAKRJDGNUQOIC-UHFFFAOYSA-N"	1	1