flow_filelinking.yaml 0000644 0000000 0000000 00000012336 14751251530 013772 0 ustar root root - parameter: inputfeatures
target: inputfeatures/Area_1_2024_12_20_12_18_54.txt
- parameter: inputspectra
target: inputspectra/Mgf_2024_12_20_12_18_55_AlignmentResult_2024_07_19_16_56_39.mgf
- parameter: input_libraries
target: input_libraries/MMV_POSITIVE.mgf
- parameter: input_libraries
target: input_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVE.mgf
- parameter: input_libraries
target: input_libraries/GNPS-COLLECTIONS-PESTICIDES-POSITIVE.mgf
- parameter: input_libraries
target: input_libraries/BMDMS-NP.mgf
- parameter: input_libraries
target: input_libraries/MSNLIB-POSITIVE.mgf
- parameter: input_libraries
target: input_libraries/CMMC-REFRAME-NEGATIVE-LIBRARY.mgf
- parameter: input_libraries
target: input_libraries/LEAFBOT.mgf
- parameter: input_libraries
target: input_libraries/BIRMINGHAM-UHPLC-MS-NEG.mgf
- parameter: input_libraries
target: input_libraries/DEREPLICATOR_IDENTIFIED_LIBRARY.mgf
- parameter: input_libraries
target: input_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY.mgf
- parameter: input_libraries
target: input_libraries/RESPECT.mgf
- parameter: input_libraries
target: input_libraries/MIADB.mgf
- parameter: input_libraries
target: input_libraries/NEO-MSMS.mgf
- parameter: input_libraries
target: input_libraries/HCE-CELL-LYSATE-LIPIDS.mgf
- parameter: input_libraries
target: input_libraries/CASMI.mgf
- parameter: input_libraries
target: input_libraries/GNPS-COLLECTIONS-PESTICIDES-NEGATIVE.mgf
- parameter: input_libraries
target: input_libraries/MSNLIB-NEGATIVE.mgf
- parameter: input_libraries
target: input_libraries/PSU-MSMLS.mgf
- parameter: input_libraries
target: input_libraries/IQAMDB.mgf
- parameter: input_libraries
target: input_libraries/GNPS-SELLECKCHEM-FDA-PART1.mgf
- parameter: input_libraries
target: input_libraries/XANTHONES-DB.mgf
- parameter: input_libraries
target: input_libraries/GNPS-D2-AMINO-LIPID-LIBRARY.mgf
- parameter: input_libraries
target: input_libraries/HMDB.mgf
- parameter: input_libraries
target: input_libraries/BIRMINGHAM-UHPLC-MS-POS.mgf
- parameter: input_libraries
target: input_libraries/MMV_NEGATIVE.mgf
- parameter: input_libraries
target: input_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf
- parameter: input_libraries
target: input_libraries/DRUGS-OF-ABUSE-LIBRARY.mgf
- parameter: input_libraries
target: input_libraries/MASSBANK.mgf
- parameter: input_libraries
target: input_libraries/BILELIB19.mgf
- parameter: input_libraries
target: input_libraries/GNPS-IOBA-NHC.mgf
- parameter: input_libraries
target: input_libraries/GNPS-MSMLS.mgf
- parameter: input_libraries
target: input_libraries/MCE-DRUG.mgf
- parameter: input_libraries
target: input_libraries/GNPS-EMBL-MCF.mgf
- parameter: input_libraries
target: input_libraries/GNPS-NIH-CLINICALCOLLECTION2.mgf
- parameter: input_libraries
target: input_libraries/GNPS-LIBRARY.mgf
- parameter: input_libraries
target: input_libraries/ECG-ACYL-AMIDES-C4-C24-LIBRARY.mgf
- parameter: input_libraries
target: input_libraries/CMMC-FOOD-BIOMARKERS.mgf
- parameter: input_libraries
target: input_libraries/MONA.mgf
- parameter: input_libraries
target: input_libraries/GNPS-NUTRI-METAB-FEM-POS.mgf
- parameter: input_libraries
target: input_libraries/ECRFS_DB.mgf
- parameter: input_libraries
target: input_libraries/GNPS-SAM-SIK-KANG-LEGACY-LIBRARY.mgf
- parameter: input_libraries
target: input_libraries/PNNL-LIPIDS-POSITIVE.mgf
- parameter: input_libraries
target: input_libraries/GNPS-NIH-CLINICALCOLLECTION1.mgf
- parameter: input_libraries
target: input_libraries/UM-NPDC.mgf
- parameter: input_libraries
target: input_libraries/LDB_POSITIVE.mgf
- parameter: input_libraries
target: input_libraries/MASSBANKEU.mgf
- parameter: input_libraries
target: input_libraries/GNPS-N-ACYL-LIPIDS-MASSQL.mgf
- parameter: input_libraries
target: input_libraries/GNPS-SELLECKCHEM-FDA-PART2.mgf
- parameter: input_libraries
target: input_libraries/GNPS-COLLECTIONS-MISC.mgf
- parameter: input_libraries
target: input_libraries/ECG-ACYL-ESTERS-C4-C24-LIBRARY.mgf
- parameter: input_libraries
target: input_libraries/DMIM-DRUG-METABOLITE-LIBRARY.mgf
- parameter: input_libraries
target: input_libraries/GNPS-NIST14-MATCHES.mgf
- parameter: input_libraries
target: input_libraries/PNNL-LIPIDS-NEGATIVE.mgf
- parameter: input_libraries
target: input_libraries/GNPS-FAULKNERLEGACY.mgf
- parameter: input_libraries
target: input_libraries/CMMC-REFRAME-POSITIVE-LIBRARY.mgf
- parameter: input_libraries
target: input_libraries/PHENOLICSDB.mgf
- parameter: input_libraries
target: input_libraries/GNPS-PRESTWICKPHYTOCHEM.mgf
- parameter: input_libraries
target: input_libraries/BERKELEY-LAB.mgf
- parameter: input_libraries
target: input_libraries/SUMNER.mgf
- parameter: input_libraries
target: input_libraries/ELIXDB-LICHEN-DATABASE.mgf
- parameter: input_libraries
target: input_libraries/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE.mgf
- parameter: input_libraries
target: input_libraries/LDB_NEGATIVE.mgf
- parameter: input_libraries
target: input_libraries/GNPS-NUTRI-METAB-FEM-NEG.mgf
- parameter: input_libraries
target: input_libraries/TUEBINGEN-NATURAL-PRODUCT-COLLECTION.mgf
- parameter: input_libraries
target: input_libraries/GNPS-SCIEX-LIBRARY.mgf
input_libraries/ 0000755 0000000 0000000 00000000000 14751251530 012752 5 ustar root root input_libraries/ECG-ACYL-AMIDES-C4-C24-LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 035514 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/ECG-ACYL-AMIDES-C4-C24-LIBRARY.mgf ustar root root input_libraries/ECRFS_DB.mgf 0000777 0000000 0000000 00000000000 14751251530 030172 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/ECRFS_DB.mgf ustar root root input_libraries/MONA.mgf 0000777 0000000 0000000 00000000000 14751251530 027040 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MONA.mgf ustar root root input_libraries/GNPS-COLLECTIONS-PESTICIDES-POSITIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 040206 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-COLLECTIONS-PESTICIDES-POSITIVE.mgf ustar root root input_libraries/GNPS-SELLECKCHEM-FDA-PART1.mgf 0000777 0000000 0000000 00000000000 14751251530 034756 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-SELLECKCHEM-FDA-PART1.mgf ustar root root input_libraries/GNPS-NIST14-MATCHES.mgf 0000777 0000000 0000000 00000000000 14751251530 033076 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIST14-MATCHES.mgf ustar root root input_libraries/PHENOLICSDB.mgf 0000777 0000000 0000000 00000000000 14751251530 031040 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/PHENOLICSDB.mgf ustar root root input_libraries/GNPS-FAULKNERLEGACY.mgf 0000777 0000000 0000000 00000000000 14751251530 033256 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-FAULKNERLEGACY.mgf ustar root root input_libraries/CMMC-REFRAME-POSITIVE-LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 036054 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/CMMC-REFRAME-POSITIVE-LIBRARY.mgf ustar root root input_libraries/RESPECT.mgf 0000777 0000000 0000000 00000000000 14751251530 027766 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/RESPECT.mgf ustar root root input_libraries/LEAFBOT.mgf 0000777 0000000 0000000 00000000000 14751251530 027704 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/LEAFBOT.mgf ustar root root input_libraries/ECG-ACYL-ESTERS-C4-C24-LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 035622 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/ECG-ACYL-ESTERS-C4-C24-LIBRARY.mgf ustar root root input_libraries/MMV_POSITIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 031516 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MMV_POSITIVE.mgf ustar root root input_libraries/BIRMINGHAM-UHPLC-MS-NEG.mgf 0000777 0000000 0000000 00000000000 14751251530 034200 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/BIRMINGHAM-UHPLC-MS-NEG.mgf ustar root root input_libraries/MSNLIB-NEGATIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 032124 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MSNLIB-NEGATIVE.mgf ustar root root input_libraries/HCE-CELL-LYSATE-LIPIDS.mgf 0000777 0000000 0000000 00000000000 14751251530 033746 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/HCE-CELL-LYSATE-LIPIDS.mgf ustar root root input_libraries/BIRMINGHAM-UHPLC-MS-POS.mgf 0000777 0000000 0000000 00000000000 14751251530 034260 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/BIRMINGHAM-UHPLC-MS-POS.mgf ustar root root input_libraries/GNPS-N-ACYL-LIPIDS-MASSQL.mgf 0000777 0000000 0000000 00000000000 14751251530 034674 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-N-ACYL-LIPIDS-MASSQL.mgf ustar root root input_libraries/GNPS-COLLECTIONS-PESTICIDES-NEGATIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 040106 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-COLLECTIONS-PESTICIDES-NEGATIVE.mgf ustar root root input_libraries/GNPS-D2-AMINO-LIPID-LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 035204 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-D2-AMINO-LIPID-LIBRARY.mgf ustar root root input_libraries/SUMNER.mgf 0000777 0000000 0000000 00000000000 14751251530 027576 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/SUMNER.mgf ustar root root input_libraries/DRUGS-OF-ABUSE-LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 034026 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/DRUGS-OF-ABUSE-LIBRARY.mgf ustar root root input_libraries/MMV_NEGATIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 031416 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MMV_NEGATIVE.mgf ustar root root input_libraries/GNPS-NIH-CLINICALCOLLECTION2.mgf 0000777 0000000 0000000 00000000000 14751251530 035546 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-CLINICALCOLLECTION2.mgf ustar root root input_libraries/MSNLIB-POSITIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 032224 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MSNLIB-POSITIVE.mgf ustar root root input_libraries/MASSBANKEU.mgf 0000777 0000000 0000000 00000000000 14751251530 030636 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MASSBANKEU.mgf ustar root root input_libraries/XANTHONES-DB.mgf 0000777 0000000 0000000 00000000000 14751251530 031240 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/XANTHONES-DB.mgf ustar root root input_libraries/GNPS-NIH-CLINICALCOLLECTION1.mgf 0000777 0000000 0000000 00000000000 14751251530 035544 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-CLINICALCOLLECTION1.mgf ustar root root input_libraries/BMDMS-NP.mgf 0000777 0000000 0000000 00000000000 14751251530 030106 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/BMDMS-NP.mgf ustar root root input_libraries/LDB_POSITIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 031422 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/LDB_POSITIVE.mgf ustar root root input_libraries/UM-NPDC.mgf 0000777 0000000 0000000 00000000000 14751251530 027662 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/UM-NPDC.mgf ustar root root input_libraries/MIADB.mgf 0000777 0000000 0000000 00000000000 14751251530 027204 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MIADB.mgf ustar root root ././@LongLink 0000644 0000000 0000000 00000000152 00000000000 011600 K ustar root root /data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf input_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 043025 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVustar root root input_libraries/GNPS-NUTRI-METAB-FEM-POS.mgf 0000777 0000000 0000000 00000000000 14751251530 034454 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NUTRI-METAB-FEM-POS.mgf ustar root root input_libraries/PNNL-LIPIDS-NEGATIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 033436 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/PNNL-LIPIDS-NEGATIVE.mgf ustar root root input_libraries/NEO-MSMS.mgf 0000777 0000000 0000000 00000000000 14751251530 030150 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/NEO-MSMS.mgf ustar root root input_libraries/GNPS-MSMLS.mgf 0000777 0000000 0000000 00000000000 14751251530 030654 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-MSMLS.mgf ustar root root input_libraries/GNPS-SAM-SIK-KANG-LEGACY-LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 036542 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-SAM-SIK-KANG-LEGACY-LIBRARY.mgf ustar root root input_libraries/GNPS-LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 031276 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-LIBRARY.mgf ustar root root input_libraries/GNPS-SCIEX-LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 033020 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-SCIEX-LIBRARY.mgf ustar root root input_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 036754 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY.mgf ustar root root input_libraries/LDB_NEGATIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 031322 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/LDB_NEGATIVE.mgf ustar root root input_libraries/PSU-MSMLS.mgf 0000777 0000000 0000000 00000000000 14751251530 030454 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/PSU-MSMLS.mgf ustar root root input_libraries/MASSBANK.mgf 0000777 0000000 0000000 00000000000 14751251530 030152 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MASSBANK.mgf ustar root root input_libraries/CMMC-REFRAME-NEGATIVE-LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 035754 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/CMMC-REFRAME-NEGATIVE-LIBRARY.mgf ustar root root ././@LongLink 0000644 0000000 0000000 00000000152 00000000000 011600 K ustar root root /data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVE.mgf input_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 042725 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVustar root root input_libraries/HMDB.mgf 0000777 0000000 0000000 00000000000 14751251530 027000 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/HMDB.mgf ustar root root input_libraries/DEREPLICATOR_IDENTIFIED_LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 037026 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/DEREPLICATOR_IDENTIFIED_LIBRARY.mgf ustar root root input_libraries/DMIM-DRUG-METABOLITE-LIBRARY.mgf 0000777 0000000 0000000 00000000000 14751251530 035600 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/DMIM-DRUG-METABOLITE-LIBRARY.mgf ustar root root input_libraries/BERKELEY-LAB.mgf 0000777 0000000 0000000 00000000000 14751251530 031150 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/BERKELEY-LAB.mgf ustar root root input_libraries/CASMI.mgf 0000777 0000000 0000000 00000000000 14751251530 027244 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/CASMI.mgf ustar root root input_libraries/CMMC-FOOD-BIOMARKERS.mgf 0000777 0000000 0000000 00000000000 14751251530 033354 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/CMMC-FOOD-BIOMARKERS.mgf ustar root root input_libraries/GNPS-EMBL-MCF.mgf 0000777 0000000 0000000 00000000000 14751251530 031332 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-EMBL-MCF.mgf ustar root root input_libraries/GNPS-NUTRI-METAB-FEM-NEG.mgf 0000777 0000000 0000000 00000000000 14751251530 034374 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NUTRI-METAB-FEM-NEG.mgf ustar root root input_libraries/GNPS-IOBA-NHC.mgf 0000777 0000000 0000000 00000000000 14751251530 031326 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-IOBA-NHC.mgf ustar root root input_libraries/MCE-DRUG.mgf 0000777 0000000 0000000 00000000000 14751251530 030062 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MCE-DRUG.mgf ustar root root input_libraries/BILELIB19.mgf 0000777 0000000 0000000 00000000000 14751251530 030204 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/BILELIB19.mgf ustar root root ././@LongLink 0000644 0000000 0000000 00000000150 00000000000 011576 K ustar root root /data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE.mgf input_libraries/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 042136 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE.ustar root root input_libraries/GNPS-COLLECTIONS-MISC.mgf 0000777 0000000 0000000 00000000000 14751251530 033704 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-COLLECTIONS-MISC.mgf ustar root root input_libraries/PNNL-LIPIDS-POSITIVE.mgf 0000777 0000000 0000000 00000000000 14751251530 033536 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/PNNL-LIPIDS-POSITIVE.mgf ustar root root input_libraries/GNPS-PRESTWICKPHYTOCHEM.mgf 0000777 0000000 0000000 00000000000 14751251530 034556 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-PRESTWICKPHYTOCHEM.mgf ustar root root input_libraries/ELIXDB-LICHEN-DATABASE.mgf 0000777 0000000 0000000 00000000000 14751251530 033676 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/ELIXDB-LICHEN-DATABASE.mgf ustar root root input_libraries/GNPS-SELLECKCHEM-FDA-PART2.mgf 0000777 0000000 0000000 00000000000 14751251530 034760 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-SELLECKCHEM-FDA-PART2.mgf ustar root root input_libraries/TUEBINGEN-NATURAL-PRODUCT-COLLECTION.mgf 0000777 0000000 0000000 00000000000 14751251530 040142 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/TUEBINGEN-NATURAL-PRODUCT-COLLECTION.mgf ustar root root input_libraries/IQAMDB.mgf 0000777 0000000 0000000 00000000000 14751251530 027446 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/IQAMDB.mgf ustar root root input_raw_spectra/ 0000755 0000000 0000000 00000000000 14751251530 013310 5 ustar root root input_supplemental_edges/ 0000755 0000000 0000000 00000000000 14751251530 014656 5 ustar root root inputfeatures/ 0000755 0000000 0000000 00000000000 14751251530 012455 5 ustar root root inputfeatures/Area_1_2024_12_20_12_18_54.txt 0000777 0000000 0000000 00000000000 14751251530 034553 2/data/nf_data/useruploads/diosphenol/DaliaAdel_TSS/Area_1_2024_12_20_12_18_54.txt ustar root root inputspectra/ 0000755 0000000 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flowchart TB
subgraph " "
v0["Channel.fromPath"]
v1["ready"]
v4["Channel.fromPath"]
v5["Channel.fromPath"]
v9["Channel.fromPath"]
v24["Channel.of"]
v28["Channel.fromPath"]
end
v2([filesummary])
subgraph " "
v3[" "]
v8["_spectra_reformatted_ch2"]
v30[" "]
v31[" "]
v33[" "]
end
v6([quantification_table_reformatted])
v7([filter_spectra])
v10([librarySearchData])
v12([librarymergeResults])
v14([summaryLibrary])
v17([librarygetGNPSAnnotations])
v19([networkingGNPSPrepParams])
v21([calculatePairs])
v23([filterNetwork])
v25([createMetadataFile])
v26([calculateGroupings])
v27([enrichClusterSummary])
v29([createNetworkGraphML])
v32([createTallRawData])
v11(( ))
v13(( ))
v15(( ))
v18(( ))
v20(( ))
v22(( ))
v0 --> v2
v0 --> v32
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v7 --> v10
v7 --> v19
v7 --> v21
v9 --> v10
v9 --> v14
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v29 --> v31
v29 --> v30
v32 --> v33
job_parameters.yaml 0000644 0000000 0000000 00000002477 14751251530 013452 0 ustar root root OMETAFLOW_SERVER: http://ometaflow-launchserver:4000
OMETALIBRARY_SERVER: http://ometalibrary-web:5000/library
OMETAMASST_SERVER: http://ometamasst-web:5000/masst
OMETATASK: 645ec447ff344b7a82f12083537167f7
OMETAUSER: diosphenol
create_time: 2025-02-06 16:30:10 PST-0800
description: 250207_TSS__DA_NEG
featurefindingtool: MSDIAL5
fragment_tolerance: '0.05'
input_libraries: /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/input_libraries
input_raw_spectra: NO_FILE
input_supplemental_edges: NO_FILE
inputfeatures: /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/inputfeatures/Area_1_2024_12_20_12_18_54.txt
inputspectra: /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/inputspectra
library_analog_max_shift: '1999'
library_analog_search: '0'
library_min_cosine: '0.7'
library_min_matched_peaks: '6'
library_topk: '1'
metadata_filename: NO_FILE
networking_max_shift: '1999'
networking_min_cosine: '0.7'
networking_min_matched_peaks: '6'
normalization: RowSum
pm_tolerance: '0.01'
precursor_filter: '1'
publishdir: /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7
task: 645ec447ff344b7a82f12083537167f7
topology_maxcomponent: '100'
topology_topk: '10'
window_filter: '1'
workflow_version: SERVER:2025.01.28;WORKFLOW:2025.01.24
workflowname: feature_based_molecular_networking_workflow
job_report.html 0000644 0000000 0000000 00013775447 14751252217 012651 0 ustar root root
[magical_mayer] Nextflow Workflow Report
Nextflow Report
Nextflow workflow report
[magical_mayer]
Workflow execution completed successfully!
Run times
07-Feb-2025 00:30:14 - 07-Feb-2025 00:35:20
( duration: 5m 6s )
143 succeeded
0 cached
0 ignored
0 failed
Nextflow command
nextflow run /app/workflows_user/feature_based_molecular_networking_workflow/nf_workflow.nf -params-file /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/job_parameters.yaml -w /data/nf_data/server/nf_work/645ec447ff344b7a82f12083537167f7 -with-report /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/job_report.html -with-timeline /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/job_timeline.html -with-dag /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/job_dag.html -with-weblog 'http://localhost:4000/nf_weblog/645ec447ff344b7a82f12083537167f7' -c /app/launchserver/nextflow_slurm.config
CPU-Hours
0.3
Launch directory
/data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7
Work directory
/data/nf_data/server/nf_work/645ec447ff344b7a82f12083537167f7
Project directory
/app/workflows_user/feature_based_molecular_networking_workflow
Script name
nf_workflow.nf
Script ID
b2294b5da7da718e7287b0a5638fc910
Workflow session
a79a6393-d501-41c4-81ae-12f5e7590659
Workflow profile
standard
Nextflow version
version 24.04.4, build 5917 (01-08-2024 07:05 UTC)
Resource Usage
These plots give an overview of the distribution of resource usage for each process.
CPU
Memory
Tasks
This table shows information about each task in the workflow. Use the search box on the right
to filter rows for specific values. Clicking headers will sort the table by that value and
scrolling side to side will reveal more columns.
(tasks table omitted because the dataset is too big)
job_timeline.html 0000644 0000000 0000000 00001072321 14751252217 013116 0 ustar root root
Processes execution timeline
Launch time:
Elapsed time:
Legend: job wall time / memory usage (RAM)
metadata_filename/ 0000755 0000000 0000000 00000000000 14751251530 013177 5 ustar root root nextflow_stdout.log 0000644 0000000 0000000 00000107444 14751252217 013547 0 ustar root root
N E X T F L O W ~ version 24.04.4
Launching `/app/workflows_user/feature_based_molecular_networking_workflow/nf_workflow.nf` [magical_mayer] DSL2 - revision: b2294b5da7
WARN: java.net.ConnectException: Connection refused
[- ] filesummary -
[- ] qua…fication_table_reformatted -
[- ] filter_spectra -
[- ] filesummary -
[- ] qua…fication_table_reformatted -
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[- ] summaryLibrary -
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[- ] createMetadataFile -
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
[- ] filesummary -
[- ] qua…fication_table_reformatted -
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[- ] summaryLibrary | 0 of 8
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[- ] createMetadataFile -
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (5)
[- ] filesummary | 0 of 1
[- ] qua…fication_table_reformatted | 0 of 1
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[80/876daa] summaryLibrary (30) | 0 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[- ] createMetadataFile | 0 of 1
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (14)
[fe/b016fe] filesummary (1) | 0 of 1
[- ] qua…fication_table_reformatted | 0 of 1
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[c3/1bb359] summaryLibrary (18) | 0 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[- ] createMetadataFile | 0 of 1
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (25)
[fe/b016fe] filesummary (1) | 0 of 1
[a3/3f4be1] qua…tion_table_reformatted (1) | 0 of 1
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[ac/dfb88c] summaryLibrary (15) | 0 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 0 of 1
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (35)
[fe/b016fe] filesummary (1) | 0 of 1
[a3/3f4be1] qua…tion_table_reformatted (1) | 0 of 1
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[dc/9088b4] summaryLibrary (8) | 0 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 0 of 1
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (44)
[fe/b016fe] filesummary (1) | 0 of 1
[a3/3f4be1] qua…tion_table_reformatted (1) | 0 of 1
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[57/787c41] summaryLibrary (41) | 0 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 0 of 1
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (52)
[fe/b016fe] filesummary (1) | 0 of 1
[a3/3f4be1] qua…tion_table_reformatted (1) | 0 of 1
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[59/b9742b] summaryLibrary (48) | 0 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 0 of 1
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (61)
[fe/b016fe] filesummary (1) | 0 of 1
[a3/3f4be1] qua…tion_table_reformatted (1) | 0 of 1
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[5f/a2972b] summaryLibrary (58) | 0 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 0 of 1
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (68)
[fe/b016fe] filesummary (1) | 0 of 1
[a3/3f4be1] qua…tion_table_reformatted (1) | 0 of 1
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[5a/76408d] summaryLibrary (64) | 0 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 0 of 1
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (68)
[fe/b016fe] filesummary (1) | 0 of 1
[a3/3f4be1] qua…tion_table_reformatted (1) | 0 of 1
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[dc/9088b4] summaryLibrary (8) | 19 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 0 of 1
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (68)
[fe/b016fe] filesummary (1) | 0 of 1
[a3/3f4be1] qua…tion_table_reformatted (1) | 0 of 1
[- ] filter_spectra -
[- ] librarySearchData -
[- ] librarymergeResults -
[dc/9088b4] summaryLibrary (8) | 19 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 0 of 1
[- ] calculateGroupings -
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[- ] createTallRawData -
executor > slurm (71)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 0 of 1
[- ] librarySearchData -
[- ] librarymergeResults -
[5a/76408d] summaryLibrary (64) | 64 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 0 of 1
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 0 of 1
executor > slurm (71)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 0 of 1
[- ] librarySearchData -
[- ] librarymergeResults -
[5a/76408d] summaryLibrary (64) | 64 of 65
[- ] librarygetGNPSAnnotations -
[- ] networkingGNPSPrepParams -
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 0 of 1
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 0 of 1
executor > slurm (76)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[e6/14d2f2] librarySearchData (2) | 0 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 0 of 1
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (88)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[85/b65624] librarySearchData (13) | 0 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 0 of 1
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (98)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[93/a02354] librarySearchData (24) | 0 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 0 of 1
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (108)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[29/3bb7ce] librarySearchData (38) | 0 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 0 of 1
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (118)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[2b/9d6925] librarySearchData (45) | 0 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 0 of 1
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (127)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[7b/e2f986] librarySearchData (54) | 0 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 0 of 1
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (136)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[43/1088bf] librarySearchData (64) | 0 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 0 of 1
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (137)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[4a/f49282] librarySearchData (65) | 0 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 0 of 1
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (137)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[4a/f49282] librarySearchData (65) | 0 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 0 of 1
[- ] calculatePairs -
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (138)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[b3/56e77e] librarySearchData (11) | 6 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 0 of 1
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (138)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[b3/56e77e] librarySearchData (11) | 6 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 0 of 1
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (138)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[b3/56e77e] librarySearchData (11) | 6 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 0 of 1
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (138)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[05/191242] librarySearchData (61) | 40 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 0 of 1
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (138)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[43/1088bf] librarySearchData (64) | 43 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 0 of 1
[- ] filterNetwork -
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (138)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[c4/21aa2e] librarySearchData (56) | 49 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[- ] filterNetwork | 0 of 1
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (139)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[c4/21aa2e] librarySearchData (56) | 49 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 0 of 1
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (139)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[5e/2e2014] librarySearchData (63) | 54 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (139)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[ca/a6b97a] librarySearchData (60) | 57 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (139)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[41/27be89] librarySearchData (57) | 58 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (139)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[d7/fd5f60] librarySearchData (41) | 59 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
executor > slurm (139)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[5d/f0f3ac] librarySearchData (58) | 61 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
executor > slurm (139)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[1f/d83c51] librarySearchData (49) | 63 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
executor > slurm (139)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[dd/58b776] librarySearchData (39) | 64 of 65
[- ] librarymergeResults -
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
executor > slurm (139)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[f6/ce32c6] librarySearchData (3) | 65 of 65 ✔
[- ] librarymergeResults | 0 of 1
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
executor > slurm (140)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[f6/ce32c6] librarySearchData (3) | 65 of 65 ✔
[11/e41daa] librarymergeResults | 0 of 1
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[- ] librarygetGNPSAnnotations -
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
executor > slurm (141)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[f6/ce32c6] librarySearchData (3) | 65 of 65 ✔
[11/e41daa] librarymergeResults | 1 of 1 ✔
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[2f/705511] librarygetGNPSAnnotations (1) | 0 of 1
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
executor > slurm (141)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[f6/ce32c6] librarySearchData (3) | 65 of 65 ✔
[11/e41daa] librarymergeResults | 1 of 1 ✔
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[2f/705511] librarygetGNPSAnnotations (1) | 0 of 1
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[- ] enrichClusterSummary -
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
executor > slurm (142)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[f6/ce32c6] librarySearchData (3) | 65 of 65 ✔
[11/e41daa] librarymergeResults | 1 of 1 ✔
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[2f/705511] librarygetGNPSAnnotations (1) | 1 of 1 ✔
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[60/acfc1b] enrichClusterSummary (1) | 0 of 1
[- ] createNetworkGraphML -
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
executor > slurm (143)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[f6/ce32c6] librarySearchData (3) | 65 of 65 ✔
[11/e41daa] librarymergeResults | 1 of 1 ✔
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[2f/705511] librarygetGNPSAnnotations (1) | 1 of 1 ✔
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[60/acfc1b] enrichClusterSummary (1) | 1 of 1 ✔
[64/fc4d14] createNetworkGraphML (1) | 0 of 1
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
executor > slurm (143)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[f6/ce32c6] librarySearchData (3) | 65 of 65 ✔
[11/e41daa] librarymergeResults | 1 of 1 ✔
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[2f/705511] librarygetGNPSAnnotations (1) | 1 of 1 ✔
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[60/acfc1b] enrichClusterSummary (1) | 1 of 1 ✔
[64/fc4d14] createNetworkGraphML (1) | 1 of 1 ✔
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
executor > slurm (143)
[fe/b016fe] filesummary (1) | 1 of 1 ✔
[a3/3f4be1] qua…tion_table_reformatted (1) | 1 of 1 ✔
[d8/3d29a4] filter_spectra (1) | 1 of 1 ✔
[f6/ce32c6] librarySearchData (3) | 65 of 65 ✔
[11/e41daa] librarymergeResults | 1 of 1 ✔
[0c/bf793d] summaryLibrary (3) | 65 of 65 ✔
[2f/705511] librarygetGNPSAnnotations (1) | 1 of 1 ✔
[88/d59266] networkingGNPSPrepParams (1) | 1 of 1 ✔
[54/48df5f] calculatePairs (1) | 1 of 1 ✔
[f0/6f1863] filterNetwork (1) | 1 of 1 ✔
[a9/97c0a3] createMetadataFile (1) | 1 of 1 ✔
[8b/8ba6ab] calculateGroupings (1) | 1 of 1 ✔
[60/acfc1b] enrichClusterSummary (1) | 1 of 1 ✔
[64/fc4d14] createNetworkGraphML (1) | 1 of 1 ✔
[f8/c8d877] createTallRawData (1) | 1 of 1 ✔
WARN: java.net.ConnectException: Connection refused
Completed at: 07-Feb-2025 00:35:21
Duration : 5m 7s
CPU hours : 0.3
Succeeded : 143
nf_cmd.sh 0000644 0000000 0000000 00000001201 14751251530 011333 0 ustar root root nextflow run /app/workflows_user/feature_based_molecular_networking_workflow/nf_workflow.nf -params-file /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/job_parameters.yaml -w /data/nf_data/server/nf_work/645ec447ff344b7a82f12083537167f7 -with-report /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/job_report.html -with-timeline /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/job_timeline.html -with-dag /data/nf_data/server/nf_tasks/645ec447ff344b7a82f12083537167f7/job_dag.html -with-weblog http://localhost:4000/nf_weblog/645ec447ff344b7a82f12083537167f7 -c /app/launchserver/nextflow.config nf_output/ 0000755 0000000 0000000 00000000000 14751252177 011612 5 ustar root root nf_output/networking/ 0000755 0000000 0000000 00000000000 14751252211 013766 5 ustar root root nf_output/networking/merged_pairs.tsv 0000644 0000000 0000000 00000014327 14751251573 017206 0 ustar root root CLUSTERID1 CLUSTERID2 DeltaMZ MinRatio Cosine AlignScore2 AlignScore3
94 144 -25.943 0.000 0.7184 0.8292 1
174 202 -15.995 0.000 0.7974 0.8420 1
204 205 -0.000 0.000 0.7572 0.7433 1
313 314 -0.000 0.000 0.8504 0.7339 1
347 385 -14.016 0.000 0.8731 0.6036 1
347 422 -28.031 0.000 0.7791 0.5670 1
385 422 -14.015 0.000 0.7753 0.5881 1
419 481 -15.995 0.000 0.7464 0.6549 1
419 482 -15.996 0.000 0.7348 0.6144 1
436 447 -2.016 0.000 0.7168 0.4115 1
441 443 -0.000 0.000 0.7693 0.4406 1
441 449 -0.001 0.000 0.8772 0.5998 1
441 450 -0.001 0.000 0.7566 0.5212 1
441 997 -166.099 0.000 0.7119 0.4620 1
443 449 -0.001 0.000 0.8256 0.4406 1
443 450 -0.001 0.000 0.7213 0.4649 1
447 626 -55.989 0.000 0.7056 0.3500 1
449 450 -0.000 0.000 0.8590 0.5845 1
449 997 -166.098 0.000 0.7385 0.4249 1
450 541 -27.994 0.000 0.7900 0.5079 1
461 996 -162.054 0.000 0.7971 0.6645 1
463 743 -95.937 0.000 0.7411 0.5114 1
463 995 -162.042 0.000 0.7710 0.6314 1
466 520 -15.995 0.000 0.7477 0.6376 1
481 482 -0.000 0.000 0.7524 0.6233 1
490 536 -15.995 0.000 0.7113 0.6006 1
519 520 -0.001 0.000 0.7036 0.5874 1
519 1079 -162.032 0.000 0.7759 0.4711 1
520 1079 -162.031 0.000 0.7591 0.4810 1
537 685 -46.007 0.000 0.7464 0.4459 1
558 1127 -162.053 0.000 0.7844 0.6142 1
558 1433 -260.211 0.000 0.7428 0.5675 1
571 1043 -138.070 0.000 0.7072 0.5969 1
599 642 -14.016 0.000 0.7225 0.4560 1
618 1427 -238.087 0.000 0.7078 0.5143 1
637 710 -23.999 0.000 0.7182 0.5072 1
664 1173 -138.032 0.000 0.7438 0.4884 1
664 1419 -222.053 0.000 0.7662 0.5876 1
664 1427 -224.070 0.000 0.7831 0.4835 1
664 1488 -252.063 0.000 0.7365 0.3912 1
664 1489 -252.064 0.000 0.7502 0.4174 1
664 1495 -254.081 0.000 0.7375 0.4895 1
685 1620 -314.135 0.000 0.7547 0.4049 1
685 1666 -342.129 0.000 0.7190 0.3631 1
721 743 -9.948 0.000 0.7674 0.5350 1
729 733 -1.979 0.000 0.7263 0.5136 1
729 753 -7.968 0.000 0.8042 0.7010 1
729 819 -31.989 0.000 0.7578 0.6055 1
729 886 -51.995 0.000 0.7223 0.5634 1
729 887 -51.996 0.000 0.7609 0.6123 1
733 753 -5.989 0.000 0.7553 0.5434 1
733 819 -30.010 0.000 0.8100 0.6949 1
733 886 -50.016 0.000 0.7337 0.5414 1
733 887 -50.017 0.000 0.7262 0.5743 1
733 1173 -110.037 0.000 0.7033 0.5015 1
753 819 -24.021 0.000 0.7326 0.5685 1
753 886 -44.027 0.000 0.7335 0.5715 1
753 887 -44.028 0.000 0.7184 0.5872 1
770 913 -46.005 0.000 0.8806 0.6884 1
782 886 -32.006 0.000 0.7030 0.5465 1
819 886 -20.006 0.000 0.7386 0.5093 1
819 887 -20.007 0.000 0.7611 0.6019 1
819 1173 -80.027 0.000 0.7533 0.5015 1
819 1221 -92.100 0.000 0.7346 0.4720 1
819 1427 -166.066 0.000 0.7309 0.4718 1
819 1428 -166.067 0.000 0.7507 0.5032 1
819 1488 -194.058 0.000 0.7162 0.4707 1
819 1489 -194.059 0.000 0.7021 0.3836 1
822 835 -1.995 0.000 0.7295 0.3906 1
826 1295 -110.015 0.000 0.7330 0.4191 1
827 1005 -39.995 0.000 0.7886 0.5091 1
827 1011 -42.011 0.000 0.7210 0.5130 1
835 1014 -42.010 0.000 0.7046 0.5731 1
836 1427 -162.054 0.000 0.7231 0.5504 1
856 857 -0.000 0.000 0.7452 0.4896 1
856 860 -2.016 0.000 0.7175 0.4414 1
857 860 -2.015 0.000 0.7811 0.5374 1
857 861 -2.015 0.000 0.7842 0.5524 1
861 973 -24.000 0.000 0.7011 0.4072 1
886 887 -0.001 0.000 0.7515 0.5643 1
886 942 -12.021 0.000 0.7180 0.4983 1
886 1173 -60.021 0.000 0.7599 0.4863 1
886 1221 -72.094 0.000 0.7436 0.4466 1
886 1320 -100.054 0.000 0.7290 0.4827 1
886 1427 -146.060 0.000 0.7248 0.4533 1
886 1428 -146.061 0.000 0.7456 0.4848 1
886 1489 -174.053 0.000 0.7729 0.4905 1
886 1495 -176.071 0.000 0.7124 0.5050 1
887 1495 -176.070 0.000 0.7105 0.5440 1
932 943 -2.015 0.000 0.7810 0.5006 1
932 946 -2.016 0.000 0.7369 0.4817 1
932 949 -2.016 0.000 0.7533 0.4507 1
932 970 -6.046 0.000 0.8028 0.5391 1
937 949 -2.016 0.000 0.7092 0.4502 1
943 949 -0.001 0.000 0.7655 0.4575 1
943 970 -4.031 0.000 0.8115 0.5573 1
946 948 -0.000 0.000 0.7041 0.4779 1
946 949 -0.000 0.000 0.7066 0.4583 1
946 970 -4.031 0.000 0.7523 0.4668 1
946 1046 -18.010 0.000 0.7398 0.4930 1
949 970 -4.030 0.000 0.7517 0.4394 1
954 1043 -15.997 0.000 0.7144 0.5104 1
989 1069 -14.017 0.000 0.7100 0.4785 1
990 1069 -14.016 0.000 0.7246 0.5177 1
995 1058 -11.963 0.000 0.7601 0.5290 1
996 1058 -11.963 0.000 0.8262 0.6873 1
996 1059 -11.963 0.000 0.7078 0.4481 1
996 1198 -46.004 0.000 0.7051 0.4485 1
1011 1145 -28.104 0.000 0.8382 0.5889 1
1014 1356 -89.975 0.000 0.7633 0.4841 1
1052 1136 -20.007 0.000 0.7048 0.4554 1
1058 1073 -4.030 0.000 0.7264 0.4428 1
1067 1069 -0.001 0.000 0.7661 0.5963 1
1083 1145 -15.995 0.000 0.7346 0.4249 1
1127 1128 -0.001 0.000 0.8327 0.6342 1
1127 1237 -25.977 0.000 0.7135 0.3991 1
1127 1433 -98.158 0.000 0.8325 0.6228 1
1135 1136 -0.001 0.000 0.7272 0.5462 1
1173 1221 -12.073 0.000 0.7348 0.4188 1
1173 1419 -84.021 0.000 0.7310 0.5860 1
1173 1427 -86.039 0.000 0.7816 0.5522 1
1173 1428 -86.040 0.000 0.7757 0.5226 1
1173 1488 -114.031 0.000 0.7325 0.4638 1
1173 1489 -114.032 0.000 0.7727 0.4826 1
1221 1427 -73.966 0.000 0.7548 0.4960 1
1221 1428 -73.967 0.000 0.7325 0.4338 1
1221 1488 -101.958 0.000 0.7137 0.5085 1
1256 1265 -4.034 0.000 0.8865 0.5727 1
1256 1279 -8.062 0.000 0.7421 0.4497 1
1260 1265 -2.015 0.000 0.8197 0.6091 1
1260 1269 -4.028 0.000 0.8327 0.6091 1
1265 1269 -2.013 0.000 0.9395 0.8366 1
1265 1279 -4.029 0.000 0.7853 0.4551 1
1266 1274 -2.016 0.000 0.8019 0.5871 1
1269 1279 -2.015 0.000 0.7762 0.4551 1
1320 1427 -46.005 0.000 0.7340 0.4739 1
1320 1428 -46.006 0.000 0.7565 0.4563 1
1320 1489 -73.999 0.000 0.7088 0.3643 1
1349 1428 -31.993 0.000 0.7178 0.5167 1
1419 1427 -2.018 0.000 0.7503 0.5522 1
1419 1488 -30.010 0.000 0.7138 0.4853 1
1419 1489 -30.011 0.000 0.7228 0.5024 1
1419 1495 -32.029 0.000 0.7334 0.5576 1
1425 1427 -0.002 0.000 0.7789 0.5813 1
1425 1428 -0.003 0.000 0.7391 0.5127 1
1425 1489 -27.995 0.000 0.7096 0.5313 1
1427 1428 -0.001 0.000 0.8432 0.6488 1
1427 1457 -15.992 0.000 0.7171 0.5350 1
1427 1462 -18.008 0.000 0.7576 0.5641 1
1427 1488 -27.993 0.000 0.7980 0.5502 1
1427 1489 -27.993 0.000 0.8134 0.5758 1
1427 1495 -30.011 0.000 0.7012 0.5243 1
1428 1462 -18.007 0.000 0.7791 0.5907 1
1428 1488 -27.992 0.000 0.8259 0.5967 1
1428 1489 -27.992 0.000 0.8415 0.6011 1
1462 1489 -9.985 0.000 0.7301 0.5334 1
1488 1489 -0.001 0.000 0.7657 0.5607 1
1524 1525 -0.023 0.000 1.0000 1.0000 1
1595 1623 -21.986 0.000 0.7049 0.5135 1
1623 1633 -6.045 0.000 0.7116 0.4877 1
1792 1889 -226.048 0.000 0.7280 0.4608 1
1819 1888 -162.127 0.000 0.7489 0.4902 1
nf_output/networking/clustersummary_with_groups.tsv 0000644 0000000 0000000 00000117156 14751251554 022301 0 ustar root root cluster index parent mass RTMean
23 102.03502 6.793
36 105.01925 10.073
38 105.01934 8.706
40 105.01939 8.972
65 108.0216 3.15
68 108.02176 7.805
69 108.02177 8.095
70 108.02178 2.91
72 108.02193 4.088
80 109.02943 3.165
81 109.02951 4.865
84 109.0659 6.843
93 111.00809 0.755
97 111.00882 1.217
102 111.08135 6.35
123 113.02426 1.524
142 115.04015 4.172
153 116.05045 7.173
163 117.01919 1.448
167 117.03462 10.833
169 117.03476 9.853
171 117.03483 11.632
184 119.05033 6.437
186 119.05073 6.14
193 121.02946 4.751
194 121.02947 2.922
196 121.02962 5.165
203 122.03736 10.314
209 123.04517 3.274
211 123.08127 4.621
212 123.08152 3.989
214 123.08162 5.023
215 123.08163 3.622
217 123.08171 4.796
227 125.02457 2.135
229 125.06081 3.498
230 125.0609 4.945
231 125.06107 3.556
234 125.09733 7.933
263 128.03525 0.776
264 128.03552 1.258
272 129.01936 1.217
275 129.01958 1.78
283 131.03487 2.268
294 132.08179 1.997
295 132.082 2.605
296 132.08218 3.379
306 133.0139 0.76
307 133.01434 0.89
308 133.02948 9.909
309 133.02953 4.878
311 133.02963 8.202
312 133.02974 9.628
313 133.0506 1.812
317 134.03729 6.739
319 134.03769 4.966
321 134.04695 1.958
335 135.02969 0.713
337 135.02998 7.37
338 135.03004 8.553
339 135.03032 7.636
341 135.04517 4.662
344 135.04628 4.96
346 136.01671 4.043
347 136.07695 9.326
367 137.02444 5.723
369 137.02463 7.612
370 137.0249 4.042
373 138.01935 4.606
375 138.01971 4.326
376 138.01982 7.802
392 139.07648 4.635
393 139.07654 6.621
394 139.07661 6.839
398 139.11292 11.867
411 141.09227 5.086
418 142.05084 2.215
419 142.05109 1.242
420 142.05125 2.285
426 143.03514 2.995
434 144.04558 4.111
435 144.04572 7.319
440 145.02953 11.632
443 145.05084 2.0
457 147.02997 8.707
464 148.04027 3.749
466 148.07704 3.56
471 149.0244 4.758
479 149.06084 5.052
502 151.04024 5.568
504 151.0764 5.27
506 151.07652 4.802
507 151.07668 8.199
508 151.0768 8.59
512 152.01157 2.913
513 152.03523 6.278
515 152.03546 10.314
516 152.03554 7.11
524 153.01945 4.15
525 153.01967 3.15
527 153.05571 3.27
536 154.01442 6.144
565 157.0141 1.736
568 157.05072 3.657
586 159.08147 12.093
593 160.07677 2.557
600 161.02429 4.121
601 161.02435 4.436
602 161.02444 9.914
605 161.02469 8.195
606 161.04553 0.66
609 161.04575 3.018
630 163.03993 6.139
632 163.03998 6.428
637 163.04019 4.298
640 163.07635 6.249
660 165.01913 4.59
661 165.01945 4.071
663 165.04082 0.697
666 165.05586 3.657
675 166.05077 3.749
688 167.03499 2.908
689 167.03517 6.186
691 167.07126 6.621
694 167.07153 6.836
701 168.03101 3.838
706 169.01443 2.135
708 169.0508 4.949
710 169.08713 4.792
713 169.12349 12.449
729 171.10278 11.944
732 171.13902 8.82
750 173.04568 5.847
751 173.0457 5.43
752 173.04573 4.659
756 173.15434 8.813
759 173.15489 9.761
781 175.0614 4.167
784 175.07648 12.269
787 176.07156 1.997
788 176.07158 2.59
789 176.07182 9.442
791 176.07207 3.379
799 177.01949 4.868
800 177.01952 4.008
804 177.05597 9.853
806 178.02702 6.739
819 179.03502 4.656
820 179.03572 4.955
821 179.05608 0.678
822 179.05617 5.371
823 179.07132 5.513
825 179.0717 8.616
826 179.07184 8.201
841 181.0506 8.126
843 181.0869 7.774
854 182.04576 2.673
884 183.13885 14.228
886 183.13889 11.822
887 183.13902 11.569
909 185.02782 5.415
910 185.02817 5.023
922 186.07707 1.977
923 186.11331 5.939
934 187.09747 7.536
936 187.09776 7.931
940 187.13403 9.518
949 189.05553 3.398
958 191.01965 1.218
961 191.05592 0.728
962 191.056 3.621
964 191.05626 4.627
966 191.0714 10.171
967 191.07143 11.632
974 192.04317 11.375
981 193.05049 6.749
983 193.05057 5.836
984 193.05064 4.768
985 193.05099 8.199
994 195.02965 3.421
996 195.04988 0.698
998 195.06612 5.049
999 195.06613 4.658
1015 197.02029 11.723
1019 197.0817 3.75
1021 197.08179 4.035
1022 197.08183 4.617
1024 197.08191 6.485
1027 197.08212 5.307
1028 197.08282 5.515
1031 197.11836 8.919
1033 197.11852 6.495
1057 199.13412 10.381
1066 200.0564 1.242
1081 201.07658 2.956
1084 201.11342 9.472
1093 203.01408 1.157
1095 203.03497 3.225
1096 203.03508 3.583
1098 203.07118 12.089
1130 207.05054 1.082
1136 207.0668 9.912
1140 208.03777 6.875
1147 209.04526 8.452
1149 209.04561 8.057
1161 209.15483 12.852
1183 211.13403 11.957
1198 213.07698 3.908
1206 213.14954 11.875
1208 214.07176 3.83
1212 215.0145 1.46
1214 215.09206 3.622
1215 215.0921 5.099
1216 215.09247 4.638
1217 215.09256 3.994
1223 215.16527 10.064
1225 215.16548 12.406
1226 215.1655 9.746
1245 217.10803 6.996
1248 217.13414 2.714
1252 218.103 2.982
1263 219.06598 12.269
1272 220.14697 13.285
1277 221.04527 4.419
1278 221.04559 4.127
1279 221.04564 6.25
1281 221.06631 1.544
1282 221.06653 0.795
1294 223.04541 0.728
1304 223.13367 12.559
1308 223.17029 13.46
1309 224.09261 3.673
1323 225.11311 10.093
1325 225.11333 5.933
1326 225.11333 8.292
1330 225.2224 15.604
1345 227.12857 11.575
1349 227.12886 6.496
1351 227.12892 11.825
1353 228.06631 7.425
1375 229.14461 12.256
1393 231.16005 11.094
1395 231.16008 11.0
1406 233.02017 12.977
1411 233.08211 9.159
1413 233.11836 11.606
1434 235.17009 14.212
1437 236.10529 13.285
1471 239.09267 5.724
1479 239.12907 6.501
1480 239.20174 13.822
1507 242.1756 11.589
1516 243.12325 8.823
1518 243.12376 8.178
1521 243.15973 12.938
1530 244.09792 10.456
1575 248.12888 9.069
1576 248.12892 9.18
1578 248.12933 9.314
1586 249.01985 2.997
1606 251.01511 2.993
1608 251.05591 4.412
1609 251.05606 5.857
1610 251.05617 4.132
1631 253.09209 13.082
1638 253.1808 12.224
1639 253.18123 12.769
1647 255.10262 5.372
1648 255.12363 7.585
1649 255.12387 8.842
1653 255.2326 15.086
1663 256.0379 11.2
1723 261.12454 2.714
1726 261.13425 7.535
1729 261.17062 11.453
1733 262.10834 6.868
1757 264.12375 6.502
1758 264.12393 6.274
1764 265.07147 4.892
1766 265.07172 5.242
1769 265.0925 1.808
1796 267.10257 12.945
1807 268.12009 9.967
1813 269.03796 11.654
1816 269.04559 7.886
1817 269.04752 10.835
1852 271.22766 15.388
1853 271.22906 15.605
1865 273.05533 2.173
1867 273.07248 6.308
1871 273.17038 12.187
1880 275.0206 0.751
1882 275.03735 0.734
1892 275.18658 12.474
1894 275.202 14.219
1901 277.01443 2.995
1913 277.14456 11.066
1916 277.21741 14.376
1923 279.10834 2.59
1925 279.12341 7.364
1933 279.23291 14.776
1947 281.06644 4.413
1950 281.0668 4.124
1959 281.13934 5.547
1960 281.13943 6.506
1973 283.0975 6.176
1978 283.15509 6.491
1982 283.19138 13.821
1991 284.03397 11.198
2002 285.04019 11.001
2006 285.04385 9.629
2015 285.207 12.63
2030 286.08502 11.062
2032 286.08505 11.367
2051 287.22305 12.361
2055 288.18158 2.484
2060 289.0174 0.905
2061 289.03674 0.754
2062 289.03815 5.696
2068 289.1196 2.653
2069 289.12372 9.861
2076 289.18048 12.287
2079 290.02551 1.275
2082 290.08804 1.242
2090 291.02948 3.656
2102 291.18143 10.283
2103 291.19632 14.439
2104 291.19647 14.326
2105 291.1965 13.215
2116 293.08771 5.688
2118 293.10016 5.979
2121 293.11816 13.185
2122 293.12375 4.407
2126 293.17584 13.278
2129 293.21176 14.787
2130 293.21225 13.059
2131 293.21298 14.943
2132 293.21326 14.219
2137 294.14954 7.144
2150 295.08191 8.355
2152 295.08243 5.679
2160 295.22769 15.093
2161 295.228 15.332
2162 295.22885 14.565
2164 296.11511 9.973
2179 297.11887 1.14
2187 297.15298 14.28
2188 297.17114 12.769
2190 297.24329 15.743
2191 297.24332 14.897
2205 299.05573 12.28
2206 299.05591 8.14
2207 299.05612 12.06
2208 299.05765 11.2
2209 299.07169 5.558
2210 299.07193 6.307
2211 299.07693 3.629
2214 299.11353 3.887
2220 299.15005 6.496
2223 299.25867 16.189
2238 301.0351 8.802
2242 301.03546 8.042
2250 301.16534 9.552
2252 301.16571 8.977
2269 303.18109 11.248
2273 303.18188 10.069
2274 303.18283 9.746
2295 305.17584 13.294
2296 305.19659 11.374
2322 307.19119 13.786
2323 307.19156 12.917
2331 309.04172 1.52
2333 309.06146 5.908
2338 309.11862 2.157
2342 309.17429 14.804
2343 309.20627 13.432
2344 309.20691 13.496
2345 309.20694 13.674
2346 309.20709 13.112
2347 310.05109 3.372
2359 311.05588 7.967
2360 311.07697 3.422
2364 311.09818 7.566
2369 311.14963 6.502
2373 311.16913 14.814
2378 311.22244 13.897
2379 311.22308 14.009
2380 311.22321 13.468
2390 313.03534 12.487
2393 313.05679 3.921
2402 313.12897 6.221
2406 313.14429 13.638
2408 313.23831 13.838
2409 313.27463 16.111
2412 314.12564 7.172
2421 315.05048 9.366
2423 315.07199 2.887
2424 315.08319 5.958
2425 315.10809 3.278
2429 315.14484 8.842
2436 315.25354 14.228
2447 317.04849 1.859
2448 317.05487 0.681
2476 319.02496 1.859
2481 319.08191 6.524
2482 319.08206 7.812
2485 319.13943 2.409
2486 319.15216 12.771
2487 319.17563 10.607
2490 319.19101 13.784
2513 321.20944 16.168
2518 322.14481 7.35
2519 322.14481 6.348
2520 322.20224 12.723
2532 323.077 6.222
2538 323.12872 13.343
2539 323.12872 12.441
2540 323.12878 12.785
2555 325.09262 5.238
2558 325.09271 4.89
2564 325.16574 11.373
2565 325.18393 14.958
2567 325.18439 15.344
2568 325.20184 12.839
2579 327.05093 13.341
2580 327.08694 6.184
2581 327.08795 6.37
2586 327.12335 11.82
2592 327.18155 13.821
2595 327.21793 11.199
2612 329.02957 12.696
2616 329.13907 10.959
2617 329.13931 10.663
2619 329.16006 7.161
2620 329.16016 8.598
2624 329.16049 6.911
2625 329.16071 6.493
2626 329.18839 14.516
2628 329.23303 12.676
2631 329.23434 11.953
2651 331.17587 7.23
2652 331.17587 10.402
2653 331.17612 13.732
2654 331.17621 9.376
2655 331.17627 8.226
2656 331.17651 12.407
2657 331.17651 12.82
2658 331.17657 8.016
2659 331.17664 12.929
2660 331.17688 7.737
2665 332.10559 5.207
2668 332.17944 8.008
2689 333.155 5.035
2695 333.19211 8.978
2697 333.207 13.147
2709 335.07718 6.226
2710 335.07739 6.095
2713 335.17151 8.969
2714 335.18619 13.077
2716 335.18634 13.349
2718 335.20724 8.404
2720 335.20773 8.147
2721 335.2189 8.491
2734 337.05621 4.501
2741 337.09268 4.318
2743 337.09338 5.427
2748 337.18347 15.018
2749 337.20508 15.809
2750 337.23822 14.02
2765 339.0722 4.008
2766 339.07416 0.689
2767 339.10596 9.861
2772 339.19965 15.602
2773 339.19995 15.838
2777 339.2536 14.609
2783 340.15515 7.124
2785 340.15524 6.591
2786 340.15533 6.949
2791 341.0824 5.959
2794 341.08777 8.649
2795 341.0878 4.417
2797 341.08829 4.129
2799 341.10822 0.718
2800 341.10883 0.911
2807 341.13901 13.715
2808 341.13916 11.455
2812 341.19623 13.145
2826 343.04575 12.068
2828 343.08194 10.728
2829 343.08218 5.378
2837 343.21222 8.824
2840 343.24854 13.942
2842 343.2851 15.952
2849 345.08002 3.017
2852 345.11865 5.693
2853 345.11908 5.892
2854 345.13452 10.829
2860 345.18152 9.095
2862 345.18396 13.759
2864 345.19135 12.724
2879 347.05597 3.025
2884 347.13419 4.253
2885 347.17065 7.637
2889 347.17114 9.751
2890 347.1712 10.889
2891 347.17123 10.35
2892 347.17209 10.019
2905 349.05371 5.557
2906 349.05417 6.303
2914 349.18622 10.24
2915 349.18625 9.388
2917 349.18649 7.723
2918 349.18655 7.932
2919 349.18845 8.488
2950 351.25345 15.123
2951 351.25366 13.921
2955 352.11813 10.663
2956 352.11917 11.725
2964 353.08749 3.617
2967 353.08856 4.662
2968 353.10825 1.041
2985 355.02841 12.692
2989 355.0668 4.419
2990 355.06683 3.679
2994 355.1033 5.674
2996 355.11859 9.388
2998 355.12387 1.649
3000 355.12454 1.225
3002 355.15469 12.513
3003 355.15491 13.34
3004 355.1575 16.266
3009 355.2485 13.225
3013 356.1864 5.815
3029 357.13373 11.844
3030 357.15292 8.967
3042 359.07678 4.446
3049 359.13458 5.307
3050 359.13483 6.466
3051 359.13489 5.511
3053 359.14938 10.236
3054 359.17099 9.864
3055 359.17114 13.596
3056 359.1712 7.557
3069 361.07401 1.527
3075 361.15018 5.267
3076 361.15024 7.182
3077 361.15085 4.793
3081 361.18613 11.226
3086 362.02972 3.376
3092 363.05081 1.514
3096 363.16537 7.821
3097 363.16559 11.456
3098 363.16559 6.437
3100 363.16565 8.703
3118 365.06476 5.958
3123 365.14484 2.406
3130 365.18253 8.703
3131 365.18314 8.541
3142 366.11884 5.797
3144 366.14093 1.599
3148 367.0621 3.032
3152 367.10297 4.773
3153 367.10364 5.847
3159 367.16037 1.642
3160 367.16074 2.359
3163 367.24884 14.375
3170 368.07742 9.187
3173 368.11401 8.998
3186 369.08441 0.69
3188 369.1188 6.524
3189 369.11893 6.784
3196 369.17004 13.687
3197 369.17047 12.983
3216 371.18405 8.125
3218 371.20758 11.973
3219 371.20779 12.222
3241 373.17764 12.577
3244 373.18631 10.809
3247 373.19769 7.909
3249 373.22293 14.119
3261 375.06946 4.641
3262 375.06946 3.617
3265 375.1293 5.635
3267 375.13254 3.381
3270 375.16556 12.521
3271 375.16562 12.819
3272 375.16592 10.059
3287 377.08392 0.703
3289 377.10071 0.723
3291 377.14236 15.59
3292 377.1442 3.94
3297 377.18121 5.989
3298 377.18127 6.4
3301 377.18143 10.653
3302 377.18179 10.42
3314 377.23315 13.3
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MIN_MATCHED_PEAKS=6
TOLERANCE_PEAK=0.05
TOLERANCE_PM=0.01
PAIRS_MIN_COSINE=0.7
MAX_SHIFT=1999.0
INPUT_SPECTRA_MS2=spectra_filtered.mgf
IDX_START=0
IDX_END=1910
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886 1320 14 0.729 -100.054
1320 1427 14 0.734 -46.005
1320 1428 14 0.7565 -46.006
1320 1489 14 0.7088 -73.999
664 1495 14 0.7375 -254.081
1419 1495 14 0.7334 -32.029
664 1419 14 0.7662 -222.053
1173 1419 14 0.731 -84.021
1419 1427 14 0.7503 -2.018
1419 1488 14 0.7138 -30.010
1419 1489 14 0.7228 -30.011
1425 1427 14 0.7789 -0.002
1425 1428 14 0.7391 -0.003
1425 1489 14 0.7096 -27.995
729 819 14 0.7578 -31.989
733 819 14 0.81 -30.010
819 886 14 0.7386 -20.006
819 1173 14 0.7533 -80.027
819 1428 14 0.7507 -166.067
819 1488 14 0.7162 -194.058
664 1173 14 0.7438 -138.032
664 1427 14 0.7831 -224.070
664 1488 14 0.7365 -252.063
664 1489 14 0.7502 -252.064
886 1428 14 0.7456 -146.061
1173 1428 14 0.7757 -86.040
1427 1428 14 0.8432 -0.001
1428 1488 14 0.8259 -27.992
1428 1489 14 0.8415 -27.992
1173 1488 14 0.7325 -114.031
1427 1488 14 0.798 -27.993
1488 1489 14 0.7657 -0.001
729 733 14 0.7263 -1.979
733 886 14 0.7337 -50.016
886 1173 14 0.7599 -60.021
886 1489 14 0.7729 -174.053
1173 1427 14 0.7816 -86.039
1427 1489 14 0.8134 -27.993
733 1173 14 0.7033 -110.037
1173 1489 14 0.7727 -114.032
1256 1279 15 0.7421 -8.062
1265 1279 15 0.7853 -4.029
1269 1279 15 0.7762 -2.015
1256 1265 15 0.8865 -4.034
1260 1265 15 0.8197 -2.015
1265 1269 15 0.9395 -2.013
1260 1269 15 0.8327 -4.028
519 520 16 0.7036 -0.001
519 1079 16 0.7759 -162.032
466 520 16 0.7477 -15.995
520 1079 16 0.7591 -162.031
1595 1623 17 0.7049 -21.986
1623 1633 17 0.7116 -6.045
490 536 18 0.7113 -15.995
1052 1136 19 0.7048 -20.007
1135 1136 19 0.7272 -0.001
537 685 20 0.7464 -46.007
685 1620 20 0.7547 -314.135
685 1666 20 0.719 -342.129
770 913 21 0.8806 -46.005
436 447 22 0.7168 -2.016
447 626 22 0.7056 -55.989
174 202 23 0.7974 -15.995
1524 1525 24 1.0 -0.023
827 1011 25 0.721 -42.011
1011 1145 25 0.8382 -28.104
1083 1145 25 0.7346 -15.995
827 1005 25 0.7886 -39.995
558 1433 27 0.7428 -260.211
1127 1433 27 0.8325 -98.158
558 1127 27 0.7844 -162.053
1127 1128 27 0.8327 -0.001
1127 1237 27 0.7135 -25.977
954 1043 28 0.7144 -15.997
571 1043 28 0.7072 -138.070
1792 1889 29 0.728 -226.048
989 1069 31 0.71 -14.017
1067 1069 31 0.7661 -0.001
990 1069 31 0.7246 -14.016
204 205 32 0.7572 -0.000
599 642 33 0.7225 -14.016
313 314 36 0.8504 -0.000
nf_output/networking/network.graphml 0000644 0000000 0000000 00000234573 14751252211 017051 0 ustar root root
0.0
0.0
0.0
0
0
221.0456
6.25
6.25
0
15
0.0
0.0
0.0
0
0
183.139
11.57
11.57
0
14
Calceolarioside B
O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](OCCc2cc(O)c(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
InChI=1S/C23H26O11/c24-14-4-1-12(9-16(14)26)3-6-19(28)33-11-18-20(29)21(30)22(31)23(34-18)32-8-7-13-2-5-15(25)17(27)10-13/h1-6,9-10,18,20-27,29-31H,7-8,11H2/b6-3+/t18-,20-,21+,22-,23-/m1/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
[(2R,3R,4S,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-4-[(3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
C[C@@H]1OC(O[C@H]2[C@H](O)[C@@H](COC(=O)/C=C/c3ccc(O)c(O)c3)O[C@@H](OCCc3ccc(O)c(O)c3)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
InChI=1S/C29H36O15/c1-13-22(35)24(37)25(38)29(42-13)44-27-23(36)20(12-41-21(34)7-4-14-2-5-16(30)18(32)10-14)43-28(26(27)39)40-9-8-15-3-6-17(31)19(33)11-15/h2-7,10-11,13,20,22-33,35-39H,8-9,12H2,1H3/b7-4+/t13-,20+,22-,23+,24+,25+,26+,27-,28+,29?/m0/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
183.1389
11.82
11.82
0
14
calceolarioside A
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@@H](CO)O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@H]1O
InChI=1S/C23H26O11/c24-11-18-22(34-19(29)6-3-12-1-4-14(25)16(27)9-12)20(30)21(31)23(33-18)32-8-7-13-2-5-15(26)17(28)10-13/h1-6,9-10,18,20-28,30-31H,7-8,11H2/b6-3+/t18-,20-,21-,22-,23-/m1/s1
148.077
3.56
3.56
0
16
4-p-Coumaroylquinic acid
O=C(/C=C/c1ccc(O)cc1)OC1[C@H](O)CC(O)(C(=O)O)C[C@H]1O
InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(20)24-14-11(18)7-16(23,15(21)22)8-12(14)19/h1-6,11-12,14,17-19,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14?,16?/m1/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
Cryptochlorogenic acid 20eV
O=C(O)[C@@]1(O)C[C@@H](O)[C@H](OC(/C=C/C2=CC(O)=C(O)C=C2)=O)[C@H](O)C1
GYFFKZTYYAFCTR-JUHZACGLSA-N
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
Neochlorogenic acid
O=C(/C=C/c1cc(O)c(O)cc1)O[C@@H]1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O
InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m1/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
213.077
3.91
3.91
0
9
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
(R)-Linalyl beta-vicianoside
C=C[C@@](C)(CCC=C(C)C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
InChI=1S/C21H36O10/c1-5-21(4,8-6-7-11(2)3)31-20-18(27)16(25)15(24)13(30-20)10-29-19-17(26)14(23)12(22)9-28-19/h5,7,12-20,22-27H,1,6,8-10H2,2-4H3/t12-,13+,14-,15+,16-,17+,18+,19-,20-,21-/m0/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
145.0508
2.0
2.0
0
2
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
171.1028
11.94
11.94
0
14
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
136.077
9.33
9.33
0
8
MassbankEU:ETS00013 C10-LAS (SAMPLE)|C10-linear alkylbenzyl sulfonate|4-(decan-4-yl)benzenesulfonic acid
OS(=O)(=O)c1ccc(cc1)C(CCC)CCCCCC
1S/C16H26O3S/c1-3-5-6-7-9-14(8-4-2)15-10-12-16(13-11-15)20(17,18)19/h10-14H,3-9H2,1-2H3,(H,17,18,19)
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
Isoacteoside
C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](OCCc3cc(O)c(O)cc3)O[C@H](COC(=O)/C=C/c3cc(O)c(O)cc3)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O
InChI=1S/C29H36O15/c1-13-22(35)24(37)25(38)29(42-13)44-27-23(36)20(12-41-21(34)7-4-14-2-5-16(30)18(32)10-14)43-28(26(27)39)40-9-8-15-3-6-17(31)19(33)11-15/h2-7,10-11,13,20,22-33,35-39H,8-9,12H2,1H3/b7-4+/t13-,20+,22-,23+,24+,25+,26+,27-,28+,29-/m0/s1
179.0718
8.2
8.2
0
13
53527-42-7
O=C(O)[C@H]1O[C@@H](Oc2c(O)ccc(-c3cc(=O)c4c(O)cc(O)cc4o3)c2)[C@H](O)[C@@H](O)[C@@H]1O
InChI=1S/C21H18O12/c22-8-4-10(24)15-11(25)6-12(31-14(15)5-8)7-1-2-9(23)13(3-7)32-21-18(28)16(26)17(27)19(33-21)20(29)30/h1-6,16-19,21-24,26-28H,(H,29,30)/t16-,17-,18+,19-,21+/m0/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
142.0511
1.24
1.24
0
5
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
CHEBI:182041
C=CC(CCCCC)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
InChI=1S/C19H34O10/c1-3-5-6-7-11(4-2)28-17-15(23)14(22)13(21)12(29-17)8-26-18-16(24)19(25,9-20)10-27-18/h4,11-18,20-25H,2-3,5-10H2,1H3/t11?,12-,13-,14+,15-,16+,17-,18-,19-/m1/s1
0.0
0.0
0.0
0
0
189.0555
3.4
3.4
0
6
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
195.0499
0.7
0.7
0
9
0.0
0.0
0.0
0
0
169.0871
4.79
4.79
0
10
(2S,3R,4S,5R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(2-phenylethoxy)oxan-3-yl]oxyoxane-3,4,5-triol
OC[C@H]1O[C@@H](OCCc2ccccc2)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O
InChI=1S/C19H28O10/c20-8-12-14(23)15(24)17(29-18-16(25)13(22)11(21)9-27-18)19(28-12)26-7-6-10-4-2-1-3-5-10/h1-5,11-25H,6-9H2/t11-,12-,13+,14-,15+,16-,17-,18+,19-/m1/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
Massbank:PR309171 DGMG 18:3
O=C(OCC(O)COC2OC(COC1OC(CO)C(O)C(O)C1(O))C(O)C(O)C2(O))CCCCCCCC=CCC=CCC=CCC
1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
Isochlorogenic acid C
O=C(/C=C/c1cc(O)c(O)cc1)O[C@H]1[C@H](O)C[C@](O)(C(=O)O)C[C@H]1OC(=O)/C=C/c1cc(O)c(O)cc1
InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)/b7-3+,8-4+/t19-,20-,23+,25-/m1/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
163.0402
4.3
4.3
0
10
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
MEGxp0_000769
C[C@]1(O)CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](COC(=O)/C=C/c4cc(O)c(O)cc4)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21
InChI=1S/C25H30O13/c1-25(34)7-6-12-13(22(32)33)9-36-23(18(12)25)38-24-21(31)20(30)19(29)16(37-24)10-35-17(28)5-3-11-2-4-14(26)15(27)8-11/h2-5,8-9,12,16,18-21,23-24,26-27,29-31,34H,6-7,10H2,1H3,(H,32,33)/b5-3+/t12-,16-,18-,19-,20+,21-,23+,24+,25+/m1/s1
0.0
0.0
0.0
0
0
133.0506
1.81
1.81
0
36
0.0
0.0
0.0
0
0
hydroquinidine
CC[C@H]1CN2CC[C@H]1C[C@H]2[C@H](O)c1ccnc2ccc(OC)cc12
InChI=1S/C20H26N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3/t13-,14-,19-,20+/m0/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
Acteoside
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@H]2OC(=O)/C=C/C3=CC(=C(C=C3)O)O)CO)OCCC4=CC(=C(C=C4)O)O)O)O)O)O
InChI=1S/C29H36O15/c1-13-22(36)23(37)24(38)29(41-13)44-27-25(39)28(40-9-8-15-3-6-17(32)19(34)11-15)42-20(12-30)26(27)43-21(35)7-4-14-2-5-16(31)18(33)10-14/h2-7,10-11,13,20,22-34,36-39H,8-9,12H2,1H3/b7-4+/t13-,20+,22-,23+,24+,25+,26+,27+,28+,29-/m0/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
CHEBI:182041
C=CC(CCCCC)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
InChI=1S/C19H34O10/c1-3-5-6-7-11(4-2)28-17-15(23)14(22)13(21)12(29-17)8-26-18-16(24)19(25,9-20)10-27-18/h4,11-18,20-25H,2-3,5-10H2,1H3/t11?,12-,13-,14+,15-,16+,17-,18-,19-/m1/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
6-O-Caffeoylarbutin
O=C(/C=C/c1cc(O)c(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
InChI=1S/C21H22O10/c22-12-3-5-13(6-4-12)30-21-20(28)19(27)18(26)16(31-21)10-29-17(25)8-2-11-1-7-14(23)15(24)9-11/h1-9,16,18-24,26-28H,10H2/b8-2+/t16-,18-,19+,20-,21-/m1/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
179.0562
5.37
5.37
0
1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
MassbankEU:ETS00014 C11-LAS (STANDARD MIX)|C11-linear alkylbenzyl sulfonate|4-(undecan-5-yl)benzenesulfonic acid
OS(=O)(=O)c1ccc(cc1)C(CCCC)CCCCCC
1S/C17H28O3S/c1-3-5-7-8-10-15(9-6-4-2)16-11-13-17(14-12-16)21(18,19)20/h11-15H,3-10H2,1-2H3,(H,18,19,20)
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
SOFOSBUVIR
CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](C)(F)[C@@H]1O)Oc1ccccc1
InChI=1S/C22H29FN3O9P/c1-13(2)33-19(29)14(3)25-36(31,35-15-8-6-5-7-9-15)32-12-16-18(28)22(4,23)20(34-16)26-11-10-17(27)24-21(26)30/h5-11,13-14,16,18,20,28H,12H2,1-4H3,(H,25,31)(H,24,27,30)/t14-,16+,18+,20+,22+,36-/m0/s1
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
154.0144
6.14
6.14
0
18
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
207.0668
9.91
9.91
0
19
SOFOSBUVIR
CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](C)(F)[C@@H]1O)Oc1ccccc1
InChI=1S/C22H29FN3O9P/c1-13(2)33-19(29)14(3)25-36(31,35-15-8-6-5-7-9-15)32-12-16-18(28)22(4,23)20(34-16)26-11-10-17(27)24-21(26)30/h5-11,13-14,16,18,20,28H,12H2,1-4H3,(H,25,31)(H,24,27,30)/t14-,16+,18+,20+,22+,36-/m0/s1
179.035
4.66
4.66
0
14
0.0
0.0
0.0
0
0
0.0
0.0
0.0
0
0
luteolin CollisionEnergy:205060
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
"InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H"
0.0
0.0
0.0
0
0
-0.001
0
0.7213
0
450
443
2
Cosine
0.7213
-0.0
0
0.859
0
450
449
-1
Cosine
0.859
-0.001
0
0.7566
0
450
441
-1
Cosine
0.7566
-27.994
-27
0.79
0
450
541
-1
Cosine
0.79
-8.062
-8
0.7421
0
1279
1256
-1
Cosine
0.7421
-4.029
-4
0.7853
0
1279
1265
-1
Cosine
0.7853
-2.015
-2
0.7762
0
1279
1269
-1
Cosine
0.7762
-176.07
-176
0.7105
0
1495
887
14
Cosine
0.7105
-254.081
-254
0.7375
0
1495
664
-1
Cosine
0.7375
-32.029
-32
0.7334
0
1495
1419
-1
Cosine
0.7334
-44.028
-44
0.7184
0
887
753
-1
Cosine
0.7184
-51.996
-51
0.7609
0
887
729
14
Cosine
0.7609
-50.017
-50
0.7262
0
887
733
-1
Cosine
0.7262
-20.007
-20
0.7611
0
887
819
14
Cosine
0.7611
-0.001
0
0.7515
0
887
886
14
Cosine
0.7515
-4.03
-4
0.7264
0
1058
1073
-1
Cosine
0.7264
-11.963
-11
0.8262
0
1058
996
9
Cosine
0.8262
-11.963
-11
0.7601
0
1058
995
-1
Cosine
0.7601
-73.966
-73
0.7548
0
1427
1221
-1
Cosine
0.7548
-18.008
-18
0.7576
0
1427
1462
-1
Cosine
0.7576
-46.005
-46
0.734
0
1427
1320
-1
Cosine
0.734
-2.018
-2
0.7503
0
1427
1419
-1
Cosine
0.7503
-0.002
0
0.7789
0
1427
1425
-1
Cosine
0.7789
-224.07
-224
0.7831
0
1427
664
-1
Cosine
0.7831
-0.001
0
0.8432
0
1427
1428
-1
Cosine
0.8432
-27.993
-27
0.798
0
1427
1488
-1
Cosine
0.798
-86.039
-86
0.7816
0
1427
1173
-1
Cosine
0.7816
-27.993
-27
0.8134
0
1427
1489
-1
Cosine
0.8134
-0.023
0
1.0
0
1525
1524
-1
Cosine
1.0
-162.042
-162
0.771
0
995
463
-1
Cosine
0.771
-0.0
0
0.7693
0
441
443
2
Cosine
0.7693
-0.001
0
0.8772
0
441
449
-1
Cosine
0.8772
-166.099
-166
0.7119
0
441
997
-1
Cosine
0.7119
-14.017
-14
0.71
0
1069
989
-1
Cosine
0.71
-0.001
0
0.7661
0
1069
1067
-1
Cosine
0.7661
-14.016
-14
0.7246
0
1069
990
-1
Cosine
0.7246
-18.01
-18
0.7398
0
1046
946
-1
Cosine
0.7398
-44.027
-44
0.7335
0
886
753
-1
Cosine
0.7335
-72.094
-72
0.7436
0
886
1221
-1
Cosine
0.7436
-100.054
-100
0.729
0
886
1320
-1
Cosine
0.729
-20.006
-20
0.7386
0
886
819
14
Cosine
0.7386
-146.061
-146
0.7456
0
886
1428
-1
Cosine
0.7456
-50.016
-50
0.7337
0
886
733
-1
Cosine
0.7337
-60.021
-60
0.7599
0
886
1173
-1
Cosine
0.7599
-174.053
-174
0.7729
0
886
1489
-1
Cosine
0.7729
-15.995
-15
0.7477
0
466
520
-1
Cosine
0.7477
-42.011
-42
0.721
0
1011
827
-1
Cosine
0.721
-28.104
-28
0.8382
0
1011
1145
-1
Cosine
0.8382
-0.001
0
0.8256
0
449
443
2
Cosine
0.8256
-166.098
-166
0.7385
0
449
997
-1
Cosine
0.7385
-0.001
0
0.7036
0
520
519
-1
Cosine
0.7036
-162.031
-162
0.7591
0
520
1079
-1
Cosine
0.7591
-0.0
0
0.7524
0
481
482
-1
Cosine
0.7524
-15.995
-15
0.7464
0
481
419
5
Cosine
0.7464
-162.032
-162
0.7759
0
519
1079
-1
Cosine
0.7759
-162.054
-162
0.7971
0
461
996
9
Cosine
0.7971
-15.995
-15
0.7974
0
202
174
-1
Cosine
0.7974
-46.004
-46
0.7051
0
1198
996
9
Cosine
0.7051
-24.0
-24
0.7011
0
973
861
-1
Cosine
0.7011
-162.127
-162
0.7489
0
1888
1819
-1
Cosine
0.7489
-2.016
-2
0.8019
0
1266
1274
-1
Cosine
0.8019
-2.015
-2
0.7842
0
861
857
-1
Cosine
0.7842
-11.963
-11
0.7078
0
1059
996
9
Cosine
0.7078
-7.968
-7
0.8042
0
729
753
-1
Cosine
0.8042
-31.989
-31
0.7578
0
729
819
14
Cosine
0.7578
-1.979
-1
0.7263
0
729
733
-1
Cosine
0.7263
-1.995
-1
0.7295
0
835
822
1
Cosine
0.7295
-42.01
-42
0.7046
0
835
1014
-1
Cosine
0.7046
-222.053
-222
0.7662
0
664
1419
-1
Cosine
0.7662
-138.032
-138
0.7438
0
664
1173
-1
Cosine
0.7438
-252.063
-252
0.7365
0
664
1488
-1
Cosine
0.7365
-252.064
-252
0.7502
0
664
1489
-1
Cosine
0.7502
-39.995
-39
0.7886
0
827
1005
-1
Cosine
0.7886
-14.016
-14
0.8731
0
347
385
-1
Cosine
0.8731
-28.031
-28
0.7791
0
347
422
-1
Cosine
0.7791
-55.989
-55
0.7056
0
626
447
-1
Cosine
0.7056
-2.016
-2
0.7168
0
447
436
-1
Cosine
0.7168
-89.975
-89
0.7633
0
1014
1356
-1
Cosine
0.7633
-15.997
-15
0.7144
0
954
1043
-1
Cosine
0.7144
-73.967
-73
0.7325
0
1428
1221
-1
Cosine
0.7325
-18.007
-18
0.7791
0
1428
1462
-1
Cosine
0.7791
-46.006
-46
0.7565
0
1428
1320
-1
Cosine
0.7565
-0.003
0
0.7391
0
1428
1425
-1
Cosine
0.7391
-166.067
-166
0.7507
0
1428
819
14
Cosine
0.7507
-86.04
-86
0.7757
0
1428
1173
-1
Cosine
0.7757
-27.992
-27
0.8259
0
1428
1488
-1
Cosine
0.8259
-27.992
-27
0.8415
0
1428
1489
-1
Cosine
0.8415
-110.015
-110
0.733
0
826
1295
-1
Cosine
0.733
-4.031
-4
0.8115
0
943
970
-1
Cosine
0.8115
-0.001
0
0.7655
0
943
949
6
Cosine
0.7655
-2.015
-2
0.781
0
943
932
-1
Cosine
0.781
-4.034
-4
0.8865
0
1265
1256
-1
Cosine
0.8865
-2.015
-2
0.8197
0
1265
1260
-1
Cosine
0.8197
-2.013
-2
0.9395
0
1265
1269
-1
Cosine
0.9395
-46.005
-46
0.8806
0
770
913
-1
Cosine
0.8806
-15.996
-15
0.7348
0
419
482
-1
Cosine
0.7348
-25.943
-25
0.7184
0
94
144
-1
Cosine
0.7184
-2.016
-2
0.7175
0
856
860
-1
Cosine
0.7175
-0.0
0
0.7452
0
856
857
-1
Cosine
0.7452
-314.135
-314
0.7547
0
1620
685
-1
Cosine
0.7547
-4.03
-4
0.7517
0
949
970
-1
Cosine
0.7517
-0.0
0
0.7066
0
949
946
-1
Cosine
0.7066
-2.016
-2
0.7533
0
949
932
-1
Cosine
0.7533
-2.016
-2
0.7092
0
949
937
-1
Cosine
0.7092
-9.985
-9
0.7301
0
1489
1462
-1
Cosine
0.7301
-73.999
-73
0.7088
0
1489
1320
-1
Cosine
0.7088
-30.011
-30
0.7228
0
1489
1419
-1
Cosine
0.7228
-27.995
-27
0.7096
0
1489
1425
-1
Cosine
0.7096
-0.001
0
0.7657
0
1489
1488
-1
Cosine
0.7657
-114.032
-114
0.7727
0
1489
1173
-1
Cosine
0.7727
-4.028
-4
0.8327
0
1269
1260
-1
Cosine
0.8327
-5.989
-5
0.7553
0
733
753
-1
Cosine
0.7553
-30.01
-30
0.81
0
733
819
14
Cosine
0.81
-110.037
-110
0.7033
0
733
1173
-1
Cosine
0.7033
-23.999
-23
0.7182
0
710
637
10
Cosine
0.7182
-25.977
-25
0.7135
0
1237
1127
-1
Cosine
0.7135
-6.045
-6
0.7116
0
1633
1623
-1
Cosine
0.7116
-0.0
0
0.7041
0
948
946
-1
Cosine
0.7041
-138.07
-138
0.7072
0
571
1043
-1
Cosine
0.7072
-342.129
-342
0.719
0
1666
685
-1
Cosine
0.719
-226.048
-226
0.728
0
1792
1889
-1
Cosine
0.728
-0.001
0
0.8327
0
1128
1127
-1
Cosine
0.8327
-21.986
-21
0.7049
0
1623
1595
-1
Cosine
0.7049
-15.995
-15
0.7113
0
490
536
18
Cosine
0.7113
-9.948
-9
0.7674
0
743
721
-1
Cosine
0.7674
-95.937
-95
0.7411
0
743
463
-1
Cosine
0.7411
-6.046
-6
0.8028
0
970
932
-1
Cosine
0.8028
-4.031
-4
0.7523
0
970
946
-1
Cosine
0.7523
-46.007
-46
0.7464
0
537
685
-1
Cosine
0.7464
-101.958
-101
0.7137
0
1488
1221
-1
Cosine
0.7137
-30.01
-30
0.7138
0
1488
1419
-1
Cosine
0.7138
-194.058
-194
0.7162
0
1488
819
14
Cosine
0.7162
-114.031
-114
0.7325
0
1488
1173
-1
Cosine
0.7325
-12.073
-12
0.7348
0
1173
1221
-1
Cosine
0.7348
-84.021
-84
0.731
0
1173
1419
-1
Cosine
0.731
-80.027
-80
0.7533
0
1173
819
14
Cosine
0.7533
-0.0
0
0.8504
0
313
314
-1
Cosine
0.8504
-14.015
-14
0.7753
0
422
385
-1
Cosine
0.7753
-2.016
-2
0.7369
0
932
946
-1
Cosine
0.7369
-260.211
-260
0.7428
0
1433
558
-1
Cosine
0.7428
-98.158
-98
0.8325
0
1433
1127
-1
Cosine
0.8325
-14.016
-14
0.7225
0
642
599
-1
Cosine
0.7225
-15.995
-15
0.7346
0
1083
1145
-1
Cosine
0.7346
-2.015
-2
0.7811
0
857
860
-1
Cosine
0.7811
-0.0
0
0.7572
0
204
205
-1
Cosine
0.7572
-24.021
-24
0.7326
0
753
819
14
Cosine
0.7326
-162.053
-162
0.7844
0
1127
558
-1
Cosine
0.7844
-20.007
-20
0.7048
0
1052
1136
19
Cosine
0.7048
-0.001
0
0.7272
0
1135
1136
19
Cosine
0.7272
-92.1
-92
0.7346
0
1221
819
14
Cosine
0.7346