Open data, open source and open standards in chemistry: The Blue Obelisk five years on

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dc.contributor.authorO'Boyle, Noel M.
dc.contributor.authorGuha, Rajarshi
dc.contributor.authorWillighagen, Egon L.
dc.contributor.authorAdams, Samuel E.
dc.contributor.authorAlvarsson, Jonathan
dc.contributor.authorBradley, Jean-Claude
dc.contributor.authorFilippov, Igor V.
dc.contributor.authorHanson, Robert M.
dc.contributor.authorHanwell, Marcus D.
dc.contributor.authorHutchison, Geoffrey R.
dc.contributor.authorJames, Craig A.
dc.contributor.authorJeliazkova, Nina
dc.contributor.authorLang, Andrew S. I. D.
dc.contributor.authorLangner, Karol M.
dc.contributor.authorLonie, David C.
dc.contributor.authorLowe, Daniel M.
dc.contributor.authorPansanel, Jérôme
dc.contributor.authorPavlov, Dmitry
dc.contributor.authorSpjuth, Ola
dc.contributor.authorSteinbeck, Christoph
dc.contributor.authorTenderholt, Adam L.
dc.contributor.authorTheisen, Kevin J.
dc.contributor.authorMurray-Rust, Peter
dc.contributor.funderHealth Research Boarden
dc.contributor.funderNational Cancer Institute, United Statesen
dc.contributor.funderNational Institutes of Health, United Statesen
dc.date.accessioned2011-11-30T15:59:33Z
dc.date.available2011-11-30T15:59:33Z
dc.date.copyright2011
dc.date.issued2011-10-14
dc.date.updated2011-11-25T08:58:20Z
dc.description.abstractBackground The Blue Obelisk movement was established in 2005 as a response to the lack of Open Data, Open Standards and Open Source (ODOSOS) in chemistry. It aims to make it easier to carry out chemistry research by promoting interoperability between chemistry software, encouraging cooperation between Open Source developers, and developing community resources and Open Standards. Results This contribution looks back on the work carried out by the Blue Obelisk in the past 5 years and surveys progress and remaining challenges in the areas of Open Data, Open Standards, and Open Source in chemistry. Conclusions We show that the Blue Obelisk has been very successful in bringing together researchers and developers with common interests in ODOSOS, leading to development of many useful resources freely available to the chemistry community.  en
dc.description.sponsorshipHealth Research Board (PD/2009/13); National Cancer Institute, United States (HHSN261200800001E); National Institutes of Health, United States (HHSN261200800001E)en
dc.description.statusPeer revieweden
dc.description.versionPublished Versionen
dc.format.mimetypeapplication/pdfen
dc.identifier.citationO'Boyle, NM; Guha, R; Willighagen, EL; Adams, SE; Alvarsson, J; Bradley, JC; Filippov, IV; Hanson, RM; Hanwell, MD; Hutchison, GR; James, CA; Jeliazkova, N; Lang, ASID; Langner, KM; Lonie, DC; Lowe, DM; Pansanel, J; Pavlov, D; Spjuth, O; Steinbeck, C; Tenderholt, AL; Theisen, KJ; Murray-Rust, P (2011) 'Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years on'. Journal of cheminformatics, 3:33. doi:10.1186/1758-2946-3-37en
dc.identifier.doi10.1186/1758-2946-3-37
dc.identifier.issn1758-2946
dc.identifier.journaltitleJournal of cheminformaticsen
dc.identifier.startpage37en
dc.identifier.urihttps://hdl.handle.net/10468/467
dc.identifier.volume3en
dc.language.isoenen
dc.publisherChemistry Centralen
dc.relation.urihttp://www.jcheminf.com/content/3/1/37
dc.rights© 2011 O'Boyle et al; licensee Chemistry Central Ltd. This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/2.0), which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.en
dc.rights.urihttp://creativecommons.org/licenses/by/2.0/en
dc.subjectOpen dataen
dc.subjectOpen standardsen
dc.subjectOpen sourceen
dc.subjectBlue Obelisken
dc.subjectChemical informaticsen
dc.subjectComputational chemistry analysisen
dc.subjectInteroperabilityen
dc.subject.lcshOpen source softwareen
dc.subject.lcshChemistry--Computer programsen
dc.titleOpen data, open source and open standards in chemistry: The Blue Obelisk five years onen
dc.typeArticle (peer-reviewed)en
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