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Workflow FEATURE-BASED-MOLECULAR-NETWORKING (version release_28.2)
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Userffiorini (federica.fiorini@helmholtz-hzi.de), HZI
Title
DSMZ_60extracts_IIMN
Re-Analyze Task Outputs Import to Re-analyze Task Data
Date Created 2022-03-20 09:07:51.0
Execution Time 13 minutes 36 seconds
Progress
MS2 File MGF/MSP(Progenesis QI)/mzML(MzTab-M)
ffiorini/DSMZ 2022/IIMN/exp2003IIN.mgf
Feature Quantification Table
ffiorini/DSMZ 2022/IIMN/exp2003IIN_quant.csv
Original mzML Files
ffiorini/DSMZ - 2nd set/pellet/112_BC3_01_25873.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/432 F_BA6_01_26743.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/482 P_BB8_01_26753.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/392 S_BE3_01_26473.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/352 K_BD3_01_26465.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/222_BB1_01_25968.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/372 O_BD7_01_26469.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/452 J_BB2_01_26747.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/132_BA7_01_25877.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/232_BA3_01_25962.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/322 E_BC5_01_26459.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/472 N_BB6_01_26751.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/442 H_BA8_01_26745.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/2G2 Q_BC1_01_26754.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/312 C_BC3_01_26457.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/332 G_BC7_01_26461.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/122_BB5_01_25867.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/2F2 R_BC2_01_26755.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/382 Q_BE1_01_26471.d.mzXML
ffiorini/DSMZ - 2nd set/pellet/342 I_BD1_01_26463.d.mzXML

Sample Metadata Table
ffiorini/DSMZ 2022/metadata_DSMZ_60extracts.txt
Supplementary Pairs
ffiorini/DSMZ 2022/IIMN/exp2003IIN_edges_msannotation.csv
Spectral Library
speclibs/GNPS-SAM-SIK-KANG-LEGACY-LIBRARY/GNPS-SAM-SIK-KANG-LEGACY-LIBRARY.mgf
speclibs/CASMI/CASMI.mgf
speclibs/GNPS-SCIEX-LIBRARY/GNPS-SCIEX-LIBRARY.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/BERKELEY-LAB/BERKELEY-LAB.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/IQAMDB/IQAMDB.mgf
speclibs/GNPS-IOBA-NHC/GNPS-IOBA-NHC.mgf
speclibs/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE.mgf