diff test-data/input01_50_without_class.csv @ 0:e8bd49794291 draft

Init repository with last lipidmaps_textsearch master version
author fgiacomoni
date Tue, 11 Apr 2017 03:47:06 -0400
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--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/input01_50_without_class.csv	Tue Apr 11 03:47:06 2017 -0400
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+ions	NeutralMass -Na	NeutralMass -NH4 	NeutralMass -H	mz	rt	mzmin	mzmax	rtsec	rtmin	rtmax	npeaks	pr172	isotopes	adduct	pcgroup
+p579.5421T0.1	565.5390	552.5210	578.5342	579.5421	0.1	579.5421	579.5421	7.5721	7.5721	7.5721	2	2			412
+p666.6033T0.1	652.6002	639.5822	665.5955	666.6033	0.1	666.6033	666.6033	4.9551	4.9551	4.9551	2	2			412
+p680.4732T0.1	666.4701	653.4521	679.4654	680.4732	0.1	680.4732	680.4732	7.5721	7.5721	7.5721	2	2			412
+p682.5927T0.1	668.5896	655.5716	681.5849	682.5927	0.1	682.5910	682.5944	8.8914	7.5721	10.2107	4	2		[M+K]+ 643.637	95
+p712.6519T0.1	698.6489	685.6309	711.6441	712.6519	0.1	712.6501	712.6537	6.2636	4.9551	7.5721	4	2			412
+p523.468T0.2	509.4649	496.4469	522.4602	523.4680	0.2	523.4668	523.4691	12.8173	12.8173	12.8173	4	2		[M+K]+ 484.508 [M+Na]+ 500.482 [M+H]+ 522.464	180
+p523.4736T0.2	509.4706	496.4526	522.4658	523.4736	0.2	523.4714	523.4759	12.8173	12.8173	12.8173	6	2		[M+K]+ 484.508 [M+Na]+ 500.482 [M+H]+ 522.464	180
+p668.6109T0.2	654.6078	641.5898	667.6031	668.6109	0.2	668.6109	668.6109	12.8173	12.8173	12.8173	2	2		[M+K]+ 629.651 [M+Na]+ 645.625 [M+H]+ 667.607	180
+p668.6174T0.2	654.6144	641.5964	667.6096	668.6174	0.2	668.6174	668.6174	12.8173	12.8173	12.8173	2	2	[520][M]+	[M+K]+ 629.651 [M+Na]+ 645.625 [M+H]+ 667.607	180
+p669.6197T0.2	655.6167	642.5987	668.6119	669.6197	0.2	669.6181	669.6214	12.8173	12.8173	12.8173	4	2	[520][M+1]+		180
+p680.485T0.2	666.4819	653.4639	679.4771	680.4850	0.2	680.4833	680.4866	10.2107	10.2107	10.2107	4	2			95
+p682.6045T0.2	668.6014	655.5834	681.5966	682.6045	0.2	682.6045	682.6045	10.2107	10.2107	10.2107	2	2		[M+K]+ 643.637	95
+p683.5928T0.2	669.5897	656.5718	682.5850	683.5928	0.2	683.5928	683.5928	10.2107	10.2107	10.2107	2	2		[M+K]+ 644.638 [M+Na]+ 660.612 [M+H]+ 682.594	95
+p683.6013T0.2	669.5982	656.5802	682.5934	683.6013	0.2	683.5962	683.6063	10.2107	10.2107	10.2107	8	2	[562][M]+	[M+K]+ 644.638 [M+Na]+ 660.612 [M+H]+ 682.594	95
+p683.6097T0.2	669.6066	656.5886	682.6019	683.6097	0.2	683.6097	683.6097	10.2107	10.2107	10.2107	2	2		[M+K]+ 644.638 [M+Na]+ 660.612 [M+H]+ 682.594	95
+p684.6036T0.2	670.6005	657.5825	683.5958	684.6036	0.2	684.6036	684.6036	10.2107	10.2107	10.2107	2	2	[562][M+1]+		95
+p700.5688T0.2	686.5658	673.5478	699.5610	700.5688	0.2	700.5671	700.5706	10.2107	10.2107	10.2107	4	2		[M+K]+ 661.613 [M+Na]+ 677.587 [M+H]+ 699.569	95
+p700.5829T0.2	686.5798	673.5618	699.5750	700.5829	0.2	700.5776	700.5881	10.2107	10.2107	10.2107	4	2		[M+K]+ 661.613 [M+Na]+ 677.587 [M+H]+ 699.569	95
+p700.5969T0.2	686.5938	673.5758	699.5890	700.5969	0.2	700.5916	700.6021	10.2107	10.2107	10.2107	8	2		[M+K]+ 661.639 [M+Na]+ 677.613	95
+p700.6074T0.2	686.6043	673.5863	699.5995	700.6074	0.2	700.6056	700.6091	10.2107	10.2107	10.2107	4	2		[M+K]+ 661.639 [M+Na]+ 677.613	95