{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,9,22]],"date-time":"2026-09-22T22:41:21Z","timestamp":1790116881377,"version":"4.0.1"},"reference-count":41,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2018,4,1]],"date-time":"2018-04-01T00:00:00Z","timestamp":1522540800000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2018,2,14]],"date-time":"2018-02-14T00:00:00Z","timestamp":1518566400000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/creativecommons.org\/licenses\/by\/4.0\/"}],"funder":[{"DOI":"10.13039\/501100004359","name":"Swedish Research Council","doi-asserted-by":"publisher","award":["521-2014-2286"],"award-info":[{"award-number":["521-2014-2286"]}],"id":[{"id":"10.13039\/501100004359","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001729","name":"Swedish Foundation for Strategic Research","doi-asserted-by":"publisher","award":["IB13-0118"],"award-info":[{"award-number":["IB13-0118"]}],"id":[{"id":"10.13039\/501100001729","id-type":"DOI","asserted-by":"publisher"}]},{"name":"Faculty of Engineering"},{"name":"Knut & Alice Wallenberg Foundation","award":["2013.0253"],"award-info":[{"award-number":["2013.0253"]}]},{"DOI":"10.13039\/501100001862","name":"Swedish Research Council FORMAS","doi-asserted-by":"publisher","award":["2016-02031"],"award-info":[{"award-number":["2016-02031"]}],"id":[{"id":"10.13039\/501100001862","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Toxicology in Vitro"],"published-print":{"date-parts":[[2018,4]]},"DOI":"10.1016\/j.tiv.2018.01.021","type":"journal-article","created":{"date-parts":[[2018,1,31]],"date-time":"2018-01-31T17:22:18Z","timestamp":1517419338000},"page":"179-187","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":30,"special_numbering":"C","title":["Predicting skin sensitizers with confidence \u2014 Using conformal prediction to determine applicability domain of GARD"],"prefix":"10.1016","volume":"48","author":[{"given":"Andy","family":"Forreryd","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-3107-331X","authenticated-orcid":false,"given":"Ulf","family":"Norinder","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Tim","family":"Lindberg","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Malin","family":"Lindstedt","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"78","reference":[{"issue":"2","key":"10.1016\/j.tiv.2018.01.021_bb0005","doi-asserted-by":"crossref","first-page":"158","DOI":"10.1016\/S0738-081X(02)00372-3","article-title":"The relationship between atopic dermatitis and contact dermatitis","volume":"21","author":"Akhavan","year":"2003","journal-title":"Clin. Dermatol."},{"key":"10.1016\/j.tiv.2018.01.021_bb0010","doi-asserted-by":"crossref","first-page":"1097","DOI":"10.1021\/tx0601004","article-title":"Mechanistic applicability domains for nonanimal-based prediction of toxicological end points: general principles and application to reactive toxicity","volume":"19","author":"Aptula","year":"2006","journal-title":"Chem. Res. Toxicol."},{"issue":"5","key":"10.1016\/j.tiv.2018.01.021_bb0015","doi-asserted-by":"crossref","first-page":"767","DOI":"10.1016\/j.tiv.2005.10.012","article-title":"Development of an in vitro skin sensitization test using human cell lines: the human Cell Line Activation Test (h-CLAT). I. Optimization of the h-CLAT protocol","volume":"20","author":"Ashikaga","year":"2006","journal-title":"Toxicol. in Vitro"},{"issue":"3","key":"10.1016\/j.tiv.2018.01.021_bb0020","doi-asserted-by":"crossref","first-page":"489","DOI":"10.1016\/j.yrtph.2012.05.013","article-title":"Putting the parts together: combining in vitro methods to test for skin sensitizing potentials","volume":"63","author":"Bauch","year":"2012","journal-title":"Regul. Toxicol. Pharmacol."},{"key":"10.1016\/j.tiv.2018.01.021_bb0025","series-title":"Artificial Intelligence Applications and Innovations","first-page":"231","article-title":"Aggregated conformal prediction","author":"Carlsson","year":"2014"},{"key":"10.1016\/j.tiv.2018.01.021_bb0030","unstructured":"CLP (2016). CLP Regulation. http:\/\/echa.europa.eu\/sv\/regulations\/clp\/ (accessed 16.07.13)."},{"key":"10.1016\/j.tiv.2018.01.021_bb0035","doi-asserted-by":"crossref","first-page":"273","DOI":"10.1007\/BF00994018","article-title":"Support-vector networks","volume":"20","author":"Cortes","year":"1995","journal-title":"Mach. Learn."},{"key":"10.1016\/j.tiv.2018.01.021_bb0040","series-title":"Algorithmic Learning Theory","first-page":"38","article-title":"Sample selection bias correction theory","author":"Cortes","year":"2008"},{"key":"10.1016\/j.tiv.2018.01.021_bb0045","author":"ECHA"},{"key":"10.1016\/j.tiv.2018.01.021_bb0050","series-title":"Identification of Mechanisms of Toxic Action for Skin Sensitization Using a SMARTS Pattern Based Approach","author":"Enoch","year":"2008"},{"key":"10.1016\/j.tiv.2018.01.021_bb0055","first-page":"1","volume":"L 396","author":"EU","year":"2006","journal-title":"Off. J. Eur. Union"},{"key":"10.1016\/j.tiv.2018.01.021_bb0060","first-page":"1","article-title":"Regulation (EC) No 1223\/2009 of the European Parliament and of the Council of 30 November 2009 on cosmetic products","volume":"L 342","author":"EU","year":"2009","journal-title":"Off. J. Eur. Union"},{"issue":"12","key":"10.1016\/j.tiv.2018.01.021_bb0065","doi-asserted-by":"crossref","first-page":"2861","DOI":"10.1007\/s00204-016-1842-4","article-title":"State of the art in non-animal approaches for skin sensitization testing: from individual test methods towards testing strategies","volume":"90","author":"Ezendam","year":"2016","journal-title":"Arch. Toxicol."},{"issue":"2 Suppl 2","key":"10.1016\/j.tiv.2018.01.021_bb0070","doi-asserted-by":"crossref","first-page":"S138","DOI":"10.1016\/j.jaci.2009.05.039","article-title":"Allergic skin diseases","volume":"125","author":"Fonacier","year":"2010","journal-title":"J. Allergy Clin. Immunol."},{"issue":"2","key":"10.1016\/j.tiv.2018.01.021_bb0075","doi-asserted-by":"crossref","first-page":"332","DOI":"10.1093\/toxsci\/kfh213","article-title":"Development of a peptide reactivity assay for screening contact allergens","volume":"81","author":"Gerberick","year":"2004","journal-title":"Toxicol. Sci."},{"issue":"12","key":"10.1016\/j.tiv.2018.01.021_bb0080","doi-asserted-by":"crossref","first-page":"2355","DOI":"10.1007\/s00204-015-1634-2","article-title":"Bayesian integrated testing strategy (ITS) for skin sensitization potency assessment: a decision support system for quantitative weight of evidence and adaptive testing strategy","volume":"89","author":"Jaworska","year":"2015","journal-title":"Arch. Toxicol."},{"key":"10.1016\/j.tiv.2018.01.021_bb0085","doi-asserted-by":"crossref","DOI":"10.1186\/1471-2164-12-399","article-title":"A genomic biomarker signature can predict skin sensitizers using a cell-based in vitro alternative to animal tests","volume":"12","author":"Johansson","year":"2011","journal-title":"BMC Genomics"},{"issue":"3","key":"10.1016\/j.tiv.2018.01.021_bb0090","doi-asserted-by":"crossref","first-page":"1163","DOI":"10.1016\/j.tiv.2012.05.019","article-title":"The GARD assay for assessment of chemical skin sensitizers","volume":"27","author":"Johansson","year":"2012","journal-title":"Toxicol. in Vitro"},{"issue":"2","key":"10.1016\/j.tiv.2018.01.021_bb0095","doi-asserted-by":"crossref","first-page":"362","DOI":"10.1093\/toxsci\/kfu046","article-title":"Genomic allergen rapid detection in-house validation\u2014a proof of concept","volume":"139","author":"Johansson","year":"2014","journal-title":"Toxicol. Sci."},{"key":"10.1016\/j.tiv.2018.01.021_bb0100","article-title":"Evaluation of the GARD assay in a blind cosmetics Europe study","author":"Johansson","year":"2017","journal-title":"ALTEX"},{"issue":"1","key":"10.1016\/j.tiv.2018.01.021_bb0105","doi-asserted-by":"crossref","first-page":"118","DOI":"10.1093\/biostatistics\/kxj037","article-title":"Adjusting batch effects in microarray expression data using empirical Bayes methods","volume":"8","author":"Johnson","year":"2007","journal-title":"Biostatistics"},{"issue":"1","key":"10.1016\/j.tiv.2018.01.021_bb0110","doi-asserted-by":"crossref","first-page":"53","DOI":"10.1021\/tx7002239","article-title":"Allergic contact dermatitis\u2014formation, structural requirements, and reactivity of skin sensitizers","volume":"21","author":"Karlberg","year":"2008","journal-title":"Chem. Res. Toxicol."},{"issue":"6","key":"10.1016\/j.tiv.2018.01.021_bb0115","doi-asserted-by":"crossref","first-page":"882","DOI":"10.1093\/bioinformatics\/bts034","article-title":"The sva package for removing batch effects and other unwanted variation in high-throughput experiments","volume":"28","author":"Leek","year":"2012","journal-title":"Bioinformatics"},{"issue":"2","key":"10.1016\/j.tiv.2018.01.021_bb0120","doi-asserted-by":"crossref","first-page":"284","DOI":"10.1093\/toxsci\/kfp228","article-title":"The Nrf2-Keap1-ARE toxicity pathway as a cellular sensor for skin sensitizers\u2014functional relevance and a hypothesis on innate reactions to skin sensitizers","volume":"113","author":"Natsch","year":"2010","journal-title":"Toxicol. Sci."},{"issue":"11","key":"10.1016\/j.tiv.2018.01.021_bb0125","doi-asserted-by":"crossref","first-page":"1337","DOI":"10.1002\/jat.2868","article-title":"A dataset on 145 chemicals tested in alternative assays for skin sensitization undergoing prevalidation","volume":"33","author":"Natsch","year":"2013","journal-title":"J. Appl. Toxicol."},{"issue":"6","key":"10.1016\/j.tiv.2018.01.021_bb0130","doi-asserted-by":"crossref","first-page":"1003","DOI":"10.1021\/acs.chemrestox.6b00037","article-title":"Conformal prediction classification of a large data set of environmental chemicals from ToxCast and Tox21 estrogen receptor assays","volume":"29","author":"Norinder","year":"2016","journal-title":"Chem. Res. Toxicol."},{"issue":"6","key":"10.1016\/j.tiv.2018.01.021_bb0135","doi-asserted-by":"crossref","first-page":"1596","DOI":"10.1021\/ci5001168","article-title":"Introducing conformal prediction in predictive modeling. A transparent and flexible alternative to applicability domain determination","volume":"54","author":"Norinder","year":"2014","journal-title":"J. Chem. Inf. Model."},{"key":"10.1016\/j.tiv.2018.01.021_bb0140","series-title":"Toxicity Testing in the 21st Century: A Vision and a Strategy","author":"NRC","year":"2007"},{"issue":"6","key":"10.1016\/j.tiv.2018.01.021_bb0145","doi-asserted-by":"crossref","first-page":"343","DOI":"10.1111\/j.1600-0536.2011.01952.x","article-title":"Predictive performance for human skin sensitizing potential of the human cell line activation test (h-CLAT)","volume":"65","author":"Nukada","year":"2011","journal-title":"Contact Dermatitis"},{"key":"10.1016\/j.tiv.2018.01.021_bb0150","author":"OECD"},{"key":"10.1016\/j.tiv.2018.01.021_bb0155","article-title":"Guidance document on the validation of (quantitative) structure-activity relationship models","volume":"69","author":"OECD","year":"2007"},{"key":"10.1016\/j.tiv.2018.01.021_bb0160","series-title":"Environment, Health and Safety Publications","article-title":"The adverse outcome pathway for skin sensitisation initiated by covalent binding to proteins, part 1: scientific evidence","volume":"168","author":"OECD","year":"2012"},{"key":"10.1016\/j.tiv.2018.01.021_bb0165","doi-asserted-by":"crossref","first-page":"147","DOI":"10.1016\/j.yrtph.2016.08.007","article-title":"Can currently available non-animal methods detect pre and pro-haptens relevant for skin sensitization?","volume":"82","author":"Patlewicz","year":"2016","journal-title":"Regul. Toxicol. Pharmacol."},{"key":"10.1016\/j.tiv.2018.01.021_bb0170","first-page":"2825","article-title":"Scikit-learn: machine learning in python","volume":"12","author":"Pedregosa","year":"2011","journal-title":"J. Mach. Learn. Res."},{"issue":"6","key":"10.1016\/j.tiv.2018.01.021_bb0175","doi-asserted-by":"crossref","first-page":"337","DOI":"10.1016\/j.ygeno.2012.08.003","article-title":"A single-sample microarray normalization method to facilitate personalized-medicine workflows","volume":"100","author":"Piccolo","year":"2012","journal-title":"Genomics"},{"key":"10.1016\/j.tiv.2018.01.021_bb0180","series-title":"R: A Language and Environment for Statistical Computing","author":"R Development Core Team","year":"2014"},{"key":"10.1016\/j.tiv.2018.01.021_bb0185","article-title":"Non-animal assessment of skin sensitization hazard: is an integrated testing strategy needed, and if so what should be integrated?","author":"Roberts","year":"2017","journal-title":"J. Appl. Toxicol."},{"issue":"4","key":"10.1016\/j.tiv.2018.01.021_bb0190","doi-asserted-by":"crossref","first-page":"626","DOI":"10.1016\/j.tiv.2014.01.003","article-title":"Skin sensitization risk assessment model using artificial neural network analysis of data from multiple in vitro assays","volume":"28","author":"Tsujita-Inoue","year":"2014","journal-title":"Toxicol. in Vitro"},{"issue":"2","key":"10.1016\/j.tiv.2018.01.021_bb0195","doi-asserted-by":"crossref","first-page":"193","DOI":"10.2131\/jts.40.193","article-title":"In silico risk assessment for skin sensitization using artificial neural network analysis","volume":"40","author":"Tsujita-Inoue","year":"2015","journal-title":"J. Toxicol. Sci."},{"key":"10.1016\/j.tiv.2018.01.021_bb0200","series-title":"Algorithmic Learning in a Random World","author":"Vovk","year":"2005"},{"issue":"4","key":"10.1016\/j.tiv.2018.01.021_bb0210","doi-asserted-by":"crossref","first-page":"539","DOI":"10.14573\/altex.1701101","article-title":"The GARD platform for potency assessment of skin sensitizing chemicals","volume":"34","author":"Zeller","year":"2017","journal-title":"ALTEX"}],"container-title":["Toxicology in Vitro"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0887233318300237?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0887233318300237?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2024,6,30]],"date-time":"2024-06-30T21:42:23Z","timestamp":1719783743000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0887233318300237"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2018,4]]},"references-count":41,"alternative-id":["S0887233318300237"],"URL":"https:\/\/doi.org\/10.1016\/j.tiv.2018.01.021","relation":{},"ISSN":["0887-2333"],"issn-type":[{"value":"0887-2333","type":"print"}],"subject":[],"published":{"date-parts":[[2018,4]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"Predicting skin sensitizers with confidence \u2014 Using conformal prediction to determine applicability domain of GARD","name":"articletitle","label":"Article Title"},{"value":"Toxicology in Vitro","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.tiv.2018.01.021","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2018 The Authors. Published by Elsevier Ltd.","name":"copyright","label":"Copyright"}]}}