Mercurial > repos > tomnl > mspurity_createdatabase
diff test-data/createMSP_output_av_all_metadata.msp @ 1:6ed8168e4736 draft
planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit e67cf7a95ce430d1d373c03992a615da2f3eeeb1
| author | tomnl |
|---|---|
| date | Tue, 04 Jun 2019 10:36:31 -0400 |
| parents | f075f67c7416 |
| children | d2b3e81e8f70 |
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--- a/test-data/createMSP_output_av_all_metadata.msp Fri May 24 08:59:45 2019 -0400 +++ b/test-data/createMSP_output_av_all_metadata.msp Tue Jun 04 10:36:31 2019 -0400 @@ -10,7 +10,7 @@ CH$LINK: PUBCHEM CID:5328 CH$NAME Unknown XCMS groupid (grpid): 12 -COMMENT: Exported from msPurity purityA object using function createMSP, using method 'av_all' msPurity version:1.11.0 +COMMENT: Exported from msPurity purityA object using function createMSP, using method 'av_all' msPurity version:1.11.1 PK$NUM_PEAK: 2 PK$PEAK: m/z int. rel.int. 112.050884246826 502873.46875 100 @@ -28,7 +28,7 @@ CH$LINK: PUBCHEM CID:5328 CH$NAME Unknown XCMS groupid (grpid): 12 -COMMENT: Exported from msPurity purityA object using function createMSP, using method 'av_all' msPurity version:1.11.0 +COMMENT: Exported from msPurity purityA object using function createMSP, using method 'av_all' msPurity version:1.11.1 PK$NUM_PEAK: 2 PK$PEAK: m/z int. rel.int. 112.050884246826 502873.46875 100