Mercurial > repos > fgiacomoni > lipidmaps_textsearch
diff test-data/out_test01.tabular @ 0:e8bd49794291 draft
Init repository with last lipidmaps_textsearch master version
| author | fgiacomoni |
|---|---|
| date | Tue, 11 Apr 2017 03:47:06 -0400 |
| parents | |
| children |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/test-data/out_test01.tabular Tue Apr 11 03:47:06 2017 -0400 @@ -0,0 +1,21 @@ +ions "NeutralMass -Na" "NeutralMass -NH4 " "NeutralMass -H" mz rt mzmin mzmax rtsec rtmin rtmax npeaks pr172 isotopes adduct pcgroup LIPIDMAPS(score::name::mz::formula::adduct::id) +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 -0.23::(PI_21:0)::(C30H59O12P)::LMGP06050025 +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 -0.18::(PI_22:0)::(C31H61O12P)::LMGP06050024 +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 -0.19::(PI_22:0)::(C31H61O12P)::LMGP06050024 +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 -0.20::(PI_22:0)::(C31H61O12P)::LMGP06050024 +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS" +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 "No_result_found_on LMDS"