Mercurial > repos > computational-metabolomics > mspurity_dimspredictpuritysingle
comparison spectralMatching.R @ 4:84d4e78d49f2 draft
"planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit cbbd708ea1e93b1b1643f6bf6da72af65ffd9950"
author | computational-metabolomics |
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date | Mon, 10 Aug 2020 08:27:57 -0400 |
parents | e96082a25ff0 |
children | 090775983be7 |
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3:8f5877c6d5f4 | 4:84d4e78d49f2 |
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290 } | 290 } |
291 | 291 |
292 q_check <- checkSPeakMeta(opt$q_dbPth, 'query') | 292 q_check <- checkSPeakMeta(opt$q_dbPth, 'query') |
293 l_check <- checkSPeakMeta(opt$l_dbPth, 'library') | 293 l_check <- checkSPeakMeta(opt$l_dbPth, 'library') |
294 | 294 |
295 | |
295 if (q_check && l_check){ | 296 if (q_check && l_check){ |
296 sm <- msPurity::spectralMatching( | 297 sm <- msPurity::spectralMatching( |
297 q_purity = opt$q_purity, | 298 q_purity = opt$q_purity, |
298 l_purity = opt$l_purity, | 299 l_purity = opt$l_purity, |
299 | 300 |