{
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  "Package": "specL",
  "Type": "Package",
  "Title": "specL - Prepare Peptide Spectrum Matches for Use in Targeted\nProteomics",
  "Version": "1.47.0",
  "Authors@R": "c(person(\"Christian\", \"Panse\", \nemail = \"cp@fgcz.ethz.ch\",\nrole = c(\"aut\", \"cre\"),\ncomment = c(ORCID = \"0000-0003-1975-3064\")),\nperson(\"Jonas\", \"Grossmann\",\nemail = \"jg@fgcz.ethz.ch\",\nrole = \"aut\",\ncomment = c(ORCID = \"0000-0002-6899-9020\")),\nperson(\"Christian\", \"Trachsel\",\nrole = \"aut\"),\nperson(\"Witold E.\", \"Wolski\",\nemail = \"wew@fgcz.ethz.ch\",\nrole = \"ctb\"))",
  "Description": "provides a functions for generating spectra libraries that\ncan be used for MRM SRM MS workflows in proteomics. The package\nprovides a BiblioSpec reader, a function which can add the\nprotein information using a FASTA formatted amino acid file,\nand an export method for using the created library in the\nSpectronaut software. The package is developed, tested and used\nat the Functional Genomics Center Zurich <https://fgcz.ch>.",
  "License": "GPL-3",
  "URL": "http://bioconductor.org/packages/specL/",
  "Collate": "read.bibliospec.R genSwathIonLib.R annotate.protein_id.R\nAllGenerics.R specL.R specLSet.R cdsw.R zzz.R",
  "biocViews": "MassSpectrometry, Proteomics",
  "LazyData": "true",
  "BugReports": "https://github.com/fgcz/specL/issues",
  "VignetteBuilder": "knitr",
  "Config/pak/sysreqs": "zlib1g-dev",
  "Repository": "https://bioc.r-universe.dev",
  "Date/Publication": "2026-04-28 12:40:12 UTC",
  "RemoteUrl": "https://github.com/bioc/specL",
  "RemoteRef": "HEAD",
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    "User": "root"
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  "Author": "Christian Panse [aut, cre] (ORCID:\n<https://orcid.org/0000-0003-1975-3064>),\nJonas Grossmann [aut] (ORCID: <https://orcid.org/0000-0002-6899-9020>),\nChristian Trachsel [aut],\nWitold E. Wolski [ctb]",
  "Maintainer": "Christian Panse <cp@fgcz.ethz.ch>",
  "_user": "bioc",
  "_type": "src",
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  "_expires": "2026-10-12T23:37:04.000Z",
  "_created": "2026-06-21T09:17:13.000Z",
  "_published": "2026-07-04T23:37:06.669Z",
  "_bioccheck": {
    "error": 0,
    "warning": 4,
    "note": 18
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  "_host": "GitHub-Actions",
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    "committer": "A Wokaty <andres.wokaty@sph.cuny.edu>",
    "message": "bump x.y.z version to odd y following creation of RELEASE_3_23 branch\n",
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    "email": "cp@fgcz.ethz.ch",
    "login": "cpanse",
    "mastodon": "@hb9feb@fosstodon.org",
    "linkedin": "in/cpanse",
    "orcid": "0000-0003-1975-3064",
    "description": "proteome informatics; ms comp; visualization; maps; code; reproducible research\n@hb9feb@fosstodon.org",
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  "_selfowned": true,
  "_usedby": 0,
  "_updates": [
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    "proteomics",
    "dda",
    "dia",
    "mass-spectrometry"
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  "_stars": 1,
  "_contributors": [
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    "name": "Bioconductor",
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    "description": "Software for the analysis and comprehension of high-throughput genomic data"
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  "_devurl": "https://github.com/fgcz/specl",
  "_searchresults": 12,
  "_rbuild": "4.6.0",
  "_assets": [
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    "extra/citation.html",
    "extra/citation.json",
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  "_homeurl": "https://github.com/fgcz/specl",
  "_realowner": "bioc",
  "_cranurl": false,
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    "generate.consensus",
    "genSwathIonLib",
    "getProteinPeptideTable",
    "ionlibrary",
    "merge.specLSet",
    "plot",
    "plot.psm",
    "plot.psmSet",
    "read.bibliospec",
    "rt.input",
    "rt.normalized",
    "show",
    "summary",
    "summary.psmSet",
    "write.spectronaut"
  ],
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      "name": "iRTpeptides",
      "title": "iRT peptides - independent retention time peptides",
      "object": "iRTpeptides",
      "class": [
        "data.frame"
      ],
      "fields": [
        "peptide",
        "rt"
      ],
      "rows": 31,
      "table": true,
      "tojson": true
    },
    {
      "name": "ms1.p2069",
      "title": "ms1 mass",
      "object": "ms1_p2069",
      "class": [
        "numeric"
      ],
      "fields": [],
      "table": false,
      "tojson": true
    },
    {
      "name": "peptideStd",
      "title": "Peptide standard",
      "object": "peptideStd",
      "class": [
        "psmSet"
      ],
      "fields": [],
      "table": true,
      "tojson": false
    },
    {
      "name": "peptideStd.redundant",
      "title": "Peptide standard",
      "object": "peptideStd",
      "class": [
        "psmSet"
      ],
      "fields": [],
      "table": true,
      "tojson": false
    }
  ],
  "_help": [
    {
      "page": "annotate.protein_id",
      "title": "Annotate protein_id",
      "topics": [
        "annotate.protein_id"
      ]
    },
    {
      "page": "cdsw",
      "title": "Generate Dynamic SWATH Window",
      "topics": [
        "cdsw",
        "generateDynamicSwathWindow"
      ]
    },
    {
      "page": "genSwathIonLib",
      "title": "Spectrum library generator for SWATH analysis",
      "topics": [
        "genSwathIonLib",
        "MRM",
        "specL",
        "SWATH",
        "swath"
      ]
    },
    {
      "page": "iRTpeptides",
      "title": "iRT peptides - independent retention time peptides",
      "topics": [
        "iRT",
        "irt",
        "iRTpeptides"
      ]
    },
    {
      "page": "ms1.p2069",
      "title": "ms1 mass",
      "topics": [
        "ms1.p2069"
      ]
    },
    {
      "page": "peptideStd",
      "title": "Peptide standard",
      "topics": [
        "peptideStd",
        "peptideStd.redundant"
      ]
    },
    {
      "page": "plot-methods",
      "title": "Method for Function 'plot' in Package 'specL'",
      "topics": [
        "plot,ANY-method",
        "plot,specL-methods",
        "plot,specLSet-methods",
        "plot-methods"
      ]
    },
    {
      "page": "read.bibliospec",
      "title": "BiblioSpec Reader",
      "topics": [
        "BiblioSpec",
        "bibliospec",
        "plot.psm",
        "plot.psmSet",
        "read.bibliospec",
        "Skyline",
        "skyline",
        "summary.psmSet"
      ]
    },
    {
      "page": "show-methods",
      "title": "Methods for Function 'show' in Package 'specL' ~~",
      "topics": [
        "show,ANY-method",
        "show-methods"
      ]
    },
    {
      "page": "specL-class",
      "title": "Class '\"specL\"'",
      "topics": [
        "plot,specL-method",
        "show,specL-method",
        "specL-class",
        "write.spectronaut,specL-method"
      ]
    },
    {
      "page": "specLSet-class",
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      "topics": [
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        "generate.consensus,specLSet-method",
        "getProteinPeptideTable",
        "getProteinPeptideTable,specLSet-method",
        "ionlibrary",
        "ionlibrary,specLSet-method",
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