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Workflow MOLECULAR-LIBRARYSEARCH-V2 (version release_28)
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Userwoutb (wout.bittremieux@uantwerpen.be), University of Antwerp
Title
Public library search 0-200
Re-Analyze Task Outputs Import to Re-analyze Task Data Attach Reanalysis Results to Dataset
Date Created 2021-06-23 10:07:38.0
Execution Time 4 days 13 hours 30 minutes 59 seconds
Progress
Spectrum Files
MSV000078547/ccms_peak/DLab/fi1026e_FT-it.mzXML
MSV000078547/ccms_peak/DLab/121115_nbut_3610_dd.mzXML
MSV000078547/ccms_peak/DLab/121204_1026B_ls_FT_IT_02.mzXML
MSV000078547/ccms_peak/DLab/120228_nbut_3610_it_it_take2.mzXML
MSV000078547/ccms_peak/DLab/121204_1026G_ls_FT_IT.mzXML
MSV000078547/ccms_peak/DLab/121119_VM37_FT-IT.mzXML
MSV000078547/ccms_peak/DLab/112111_ES129_ltq_ltq.mzXML
MSV000078547/ccms_peak/DLab/121114_nanoDESI_polar_ISP2_SRM7_DD_MS2.mzXML
MSV000078547/ccms_peak/DLab/fi1026c_FT-it.mzXML
MSV000078547/ccms_peak/DLab/121207_aby_L_DD_MS2.mzXML
MSV000078547/ccms_peak/DLab/112111_ES129_fr111109_jy_ft_ltq.mzXML
MSV000078547/ccms_peak/DLab/121115_srf_dd02.mzXML
MSV000078547/ccms_peak/DLab/121207_aby_J_DD_MS2.mzXML
MSV000078547/ccms_peak/DLab/112111_nonpolar_ES129_ft_ltq.mzXML
MSV000078547/ccms_peak/DLab/121115_nbut_PY79_dd.mzXML
MSV000078547/ccms_peak/DLab/fi1026F_FT-IT.mzXML
MSV000078547/ccms_peak/DLab/120228_nbut_3610_ft_it.mzXML
MSV000078547/ccms_peak/DLab/121207_aby_H_DD_MS2.mzXML
MSV000078547/ccms_peak/DLab/121207_aby_C_DD_MS2.mzXML
MSV000078547/ccms_peak/DLab/120228_nbut_ES129_ft_it_take2.mzXML
Spectral Library
speclibs/CASMI/CASMI.mgf
speclibs/MONA/MONA.mgf
speclibs/GNPS-NIH-CLINICALCOLLECTION2/GNPS-NIH-CLINICALCOLLECTION2.mgf
speclibs/GNPS-SELLECKCHEM-FDA-PART1/GNPS-SELLECKCHEM-FDA-PART1.mgf
speclibs/GNPS-COLLECTIONS-PESTICIDES-NEGATIVE/GNPS-COLLECTIONS-PESTICIDES-NEGATIVE.mgf
speclibs/LDB_POSITIVE/LDB_POSITIVE.mgf
speclibs/GNPS-NIH-NATURALPRODUCTSLIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY.mgf
speclibs/GNPS-NIH-CLINICALCOLLECTION1/GNPS-NIH-CLINICALCOLLECTION1.mgf
speclibs/MMV_POSITIVE/MMV_POSITIVE.mgf
speclibs/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVE/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVE.mgf
speclibs/GNPS-SELLECKCHEM-FDA-PART2/GNPS-SELLECKCHEM-FDA-PART2.mgf
speclibs/PNNL-LIPIDS/PNNL-LIPIDS-NEGATIVE.mgf
speclibs/PNNL-LIPIDS/PNNL-LIPIDS-POSITIVE.mgf
speclibs/GNPS-NIST14-MATCHES/GNPS-NIST14-MATCHES.mgf
speclibs/GNPS-IOBA-NHC/GNPS-IOBA-NHC.mgf
speclibs/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE.mgf
speclibs/BILELIB19/BILELIB19.mgf
speclibs/HCE-CELL-LYSATE-LIPIDS/HCE-CELL-LYSATE-LIPIDS.mgf
speclibs/GNPS-EMBL-MCF/GNPS-EMBL-MCF.mgf
speclibs/GNPS-PRESTWICKPHYTOCHEM/GNPS-PRESTWICKPHYTOCHEM.mgf