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A crystallographic perspective on sharing data and knowledge

The crystallographic community is in many ways an exemplar of the benefits and practices of sharing data. Since the inception of the technique, virtually every published crystal structure has been made available to others. This has been achieved through the establishment of several specialist data c...

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Detalles Bibliográficos
Autores principales: Bruno, Ian J., Groom, Colin R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4196029/
https://www.ncbi.nlm.nih.gov/pubmed/25091065
http://dx.doi.org/10.1007/s10822-014-9780-9
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author Bruno, Ian J.
Groom, Colin R.
author_facet Bruno, Ian J.
Groom, Colin R.
author_sort Bruno, Ian J.
collection PubMed
description The crystallographic community is in many ways an exemplar of the benefits and practices of sharing data. Since the inception of the technique, virtually every published crystal structure has been made available to others. This has been achieved through the establishment of several specialist data centres, including the Cambridge Crystallographic Data Centre, which produces the Cambridge Structural Database. Containing curated structures of small organic molecules, some containing a metal, the database has been produced for almost 50 years. This has required the development of complex informatics tools and an environment allowing expert human curation. As importantly, a financial model has evolved which has, to date, ensured the sustainability of the resource. However, the opportunities afforded by technological changes and changing attitudes to sharing data make it an opportune moment to review current practices.
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spelling pubmed-41960292014-10-16 A crystallographic perspective on sharing data and knowledge Bruno, Ian J. Groom, Colin R. J Comput Aided Mol Des Article The crystallographic community is in many ways an exemplar of the benefits and practices of sharing data. Since the inception of the technique, virtually every published crystal structure has been made available to others. This has been achieved through the establishment of several specialist data centres, including the Cambridge Crystallographic Data Centre, which produces the Cambridge Structural Database. Containing curated structures of small organic molecules, some containing a metal, the database has been produced for almost 50 years. This has required the development of complex informatics tools and an environment allowing expert human curation. As importantly, a financial model has evolved which has, to date, ensured the sustainability of the resource. However, the opportunities afforded by technological changes and changing attitudes to sharing data make it an opportune moment to review current practices. Springer International Publishing 2014-08-05 2014 /pmc/articles/PMC4196029/ /pubmed/25091065 http://dx.doi.org/10.1007/s10822-014-9780-9 Text en © The Author(s) 2014 https://creativecommons.org/licenses/by/4.0/ Open AccessThis article is distributed under the terms of the Creative Commons Attribution License which permits any use, distribution, and reproduction in any medium, provided the original author(s) and the source are credited.
spellingShingle Article
Bruno, Ian J.
Groom, Colin R.
A crystallographic perspective on sharing data and knowledge
title A crystallographic perspective on sharing data and knowledge
title_full A crystallographic perspective on sharing data and knowledge
title_fullStr A crystallographic perspective on sharing data and knowledge
title_full_unstemmed A crystallographic perspective on sharing data and knowledge
title_short A crystallographic perspective on sharing data and knowledge
title_sort crystallographic perspective on sharing data and knowledge
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4196029/
https://www.ncbi.nlm.nih.gov/pubmed/25091065
http://dx.doi.org/10.1007/s10822-014-9780-9
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