1877 16 6780 2 38554 document 6780 README.txt text/plain 87f84d9d1a20314dac3c8eda4f27a972 MD5 840 2025-02-24 09:45:50 https://researchdata.gla.ac.uk/1877/1/README.txt 1877 1 1 text/plain Text en public cc_by_4

README.txt

readme 6781 3 38556 document 6781 matching_seeds.zip application/zip d1d047dadb5e733852474d216ab8e474 MD5 1811425282 2025-02-24 09:46:23 https://researchdata.gla.ac.uk/1877/2/matching_seeds.zip 1877 2 2 application/zip Code en public cc_by_4

matching_seeds.zip

data 6782 1 38565 document 6782 indexcodes.txt text/plain 34be32b82d38bb9d5080bdf3527528d2 MD5 440 2025-02-24 09:59:16 https://researchdata.gla.ac.uk/1877/3/indexcodes.txt 1877 3 3 text/plain other Generate index codes conversion from Text to indexcodes en public

indexcodes.txt

http://eprints.org/relation/isVersionOf https://researchdata.gla.ac.uk/id/document/6780 http://eprints.org/relation/isVolatileVersionOf https://researchdata.gla.ac.uk/id/document/6780 http://eprints.org/relation/isIndexCodesVersionOf https://researchdata.gla.ac.uk/id/document/6780 archive 32963 disk0/00/00/18/77 2025-02-24 09:53:31 2025-02-24 09:53:44 2025-02-24 09:53:31 data_collection show McBride Ross 57011 Weidt Stefan 28509 Wandy Joe 36328 0000-0002-3068-4664 Davies Vinny 38634 0000-0003-1896-8936 Daly Rónán 11000 0000-0002-1275-6820 Bryson Kevin 61566 0000-0002-1163-6368 glaresearchdata:2025-02-20-1877 pub 20000000 30200000 30502000 This dataset contains the mzML files produced from liquid chromatography tandem mass spectrometry (LC-MS/MS) measurements of 4 beer samples. Files with ID 1-12 are sequential acquisitions of a single type of beer sample. Files with ID 13-16 are sequential acquisitions of four different beer types, in round-robin order (1-2-3-4-1-2-3-4...). All .mzMLs were run in fullscan (MS1-only) mode. They were used as a base to create simulated experiments in ViMMS. These simulated experiments were used to test the performance of an novel acquisition methods based on maximum bipartite matching. These data can be used as input to ViMMS to reproduce the simulation studies in question. 2025-02-20 published University of Glasgow 10.5525/gla.researchdata.1877 Code University of Glasgow 300982 Exploiting Closed-Loop Aspects in Computationally and Data Intensive Analytics Roderick Murray-Smith Engineering and Physical Sciences Research Council (EPSRC) EP/R018634/1 Computing Science FALSE English 2024-08-14 2024-08-15 2035-02-20 R file_transfer FALSE FALSE