Mercurial > repos > fgiacomoni > golm_ws_lib_search
view test-data/output01.txt @ 0:e3d43b8c987b draft
Init repository with last tool-bank-golm-lib_search master version
author | fgiacomoni |
---|---|
date | Mon, 05 Dec 2016 08:32:04 -0500 |
parents | |
children | 11779b6402bc |
line wrap: on
line source
Num Spectre Analyte Name Spectrum Name Retention Index RI Discrepancy DotproductDistance EuclideanDistance JaccardDistance HammingDistance s12GowerLegendreDistance Spectrum ID Metabolite ID Analyte ID 1 Glucose (1MEOX) (5TMS) BP Glucose (1MEOX) (5TMS) BP [A191001-ambient-na-12] 1899.05493 1.054953 0.4861827 0.0871585 0.8515625 109 0.784043431 833ab58c-a8fa-4389-8b42-95e618cafb91 68513255-fc44-4041-bc4b-4fd2fae7541d 0a2b3536-2245-4c0e-bdbc-495766eeec67 1 Galactose (1MEOX) (5TMS) BP Galactose (1MEOX) (5TMS) BP [A191002-ambient-DL--6] 1902.42212 4.422119 0.4875465 0.0869417042 0.852713168 110 0.784997046 6e056b61-4da9-46e3-970b-680a22e4afd0 dd3ea070-54a6-4ea7-b99b-a6e975fdd204 1c3ad0aa-ee78-4542-93b3-aa9fdf07add1 1 Idose (1MEOX) (5TMS) BP Idose (1MEOX) (5TMS) BP [A191005-ambient-na-1] 1897.25439 0.745605469 0.4901554 0.0861777 0.8560606 113 0.7877858 d00de57d-6fab-49d0-9aee-25e259da9180 ab025068-f464-4bc6-9c92-994c29387db2 6f4e926f-d7ef-47b6-a52c-91ff88ca567a 1 Allantoin (5TMS) Allantoin (5TMS) [A188009-ambient-na-5] 1896.99829 1.001709 0.4914575 0.09410148 0.8558559 95 0.804233432 817f2a03-9df5-46e3-973c-b2a9675109cf a999f0d6-0285-41d9-a6ba-b705987b663c 65bb54d2-6bf7-4a53-aa22-8abf71240005 1 Glucose, U-13C- (1MEOX) (5TMS) BP Glucose, U-13C- (1MEOX) (5TMS) BP [A191001-13C-na-2] 1901.63 3.63 0.497226775 0.0910335854 0.85 102 0.788321555 27d4dcdd-d351-4976-8ef9-76a0cc53f631 441faccb-2631-4e7d-b6ca-99437265ccb8 96441b61-2891-4e81-93dc-d0fc0ad175d4 2 no results 3 Glucose (1MEOX) (5TMS) BP Glucose (1MEOX) (5TMS) BP [A191001-ambient-na-12] 1899.05493 1.054953 0.487051964 0.0868976042 0.8604651 111 0.79687 833ab58c-a8fa-4389-8b42-95e618cafb91 68513255-fc44-4041-bc4b-4fd2fae7541d 0a2b3536-2245-4c0e-bdbc-495766eeec67 3 Galactose (1MEOX) (5TMS) BP Galactose (1MEOX) (5TMS) BP [A191002-ambient-DL--6] 1902.42212 4.422119 0.4883618 0.08667906 0.86153847 112 0.797758937 6e056b61-4da9-46e3-970b-680a22e4afd0 dd3ea070-54a6-4ea7-b99b-a6e975fdd204 1c3ad0aa-ee78-4542-93b3-aa9fdf07add1 3 Idose (1MEOX) (5TMS) BP Idose (1MEOX) (5TMS) BP [A191005-ambient-na-1] 1897.25439 0.745605469 0.491137743 0.0859391 0.864661634 115 0.8003591 d00de57d-6fab-49d0-9aee-25e259da9180 ab025068-f464-4bc6-9c92-994c29387db2 6f4e926f-d7ef-47b6-a52c-91ff88ca567a 3 Allantoin (5TMS) Allantoin (5TMS) [A188009-ambient-na-5] 1896.99829 1.001709 0.4918884 0.09372151 0.8660714 97 0.817842841 817f2a03-9df5-46e3-973c-b2a9675109cf a999f0d6-0285-41d9-a6ba-b705987b663c 65bb54d2-6bf7-4a53-aa22-8abf71240005 3 Glucose, U-13C- (1MEOX) (5TMS) BP Glucose, U-13C- (1MEOX) (5TMS) BP [A191001-13C-na-2] 1901.63 3.63 0.49828127 0.0907527059 0.8595041 104 0.8015494 27d4dcdd-d351-4976-8ef9-76a0cc53f631 441faccb-2631-4e7d-b6ca-99437265ccb8 96441b61-2891-4e81-93dc-d0fc0ad175d4 4 no results