Data Repository Project

DOI: 10.14469/hpc/1088 Metadata

Created: 2016-07-25 05:52

Last modified: 2021-10-16 07:32

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Co-author: Andrew McLean
Co-author: Charles ROMAIN
Co-author: Matthew Harvey

Description

A FAIR Data project involving the design and deployment of a data repository containing enhanced features.

Members

DOIDescription
10.14469/hpc/2578 NMR Data with intrinsic ORCID identifier
10.14469/hpc/1975 199Hg NMR chemical shifts: a comparison between calculated and measured values
10.14469/hpc/3055 Executes the following search as: search.datacite.org/works?query=media:chemical\/x\-mnpub*
10.14469/hpc/4558 DataCite searches enabled using the Subject Scheme element
10.14469/hpc/1369 XML registration with re3data
10.14469/hpc/4738 Metadata Recommendations for DataCite Registration.
10.14469/hpc/4584 FAIR Data Figure. Mechanistic insights into boron-catalysed direct amidation reactions
10.14469/hpc/4919 FAIR Data Figure. Mechanistic insights into boron-catalysed direct amidation reactions
10.14469/hpc/4739 Metadata Recommendations for DataCite Registration.
10.14469/hpc/5089 March 11th test deposition
10.14469/hpc/5095 Test
10.14469/hpc/1053 Demonstration of Professional Preview of FAIR (Findable, accessable, inter-operable and re-usable) NMR Data files using MestreNova and Mpublish.
10.14469/hpc/6213 Jeol JDF format
10.14469/hpc/5920 Exploiting the DataCite schema and Elastic Search for complex queries
10.14469/hpc/5982 Proposed exploitation of DataCite metadata schema for Chemistry metadata registration
10.14469/hpc/9536 Preparing Live View documents for the Imperial college Data Repository

Associated DOIs

Current dataset ...DOIDescription
References 10.1021/acsomega.7b00482 Published article on Synthesis and Reactions of Benzannulated Spiroaminals; Tetrahydrospirobiquinolines
References 10.1021/ci500302p Digital data repositories in chemistry and their integration with journals and electronic laboratory notebooks
References 10.1021/ci7004737 SPECTRa : The Deposition and Validation of Primary Chemistry Research Data in Digital Repositories
References 10.1021/ci9003688 SPECTRa-T: Machine-based data extraction and semantic searching of chemistry e-theses
References 10.1186/s13321-015-0081-7 Standards-based metadata procedures for retrieving data for display or mining utilizing Persistent (data-DOI) Identifier
References 10.1186/s13321-015-0093-3 Standards-based curation of a decade-old digital repository dataset of molecular information
References 10.1186/s13321-017-0190-6 A metadata-driven approach to data repository design
References 10.14469/hpc/1248 Example of an Active (HTML) Preview.
References 10.14469/hpc/1267 Example of professional preview (ProView) of instrumental data.
References 10.14469/hpc/1487 Github source code for data repository
References 10.14469/hpc/2017 NMR data for Total Synthesis of (+)-Lophirone H and its Pentamethylether Utilizing an Oxonium-Prins Cyclisation
References 10.14469/hpc/2294 NMR data for Synthesis and Reactions of Benzannulated Spiroaminals; Tetrahydrospirobiquinolines
References 10.14469/hpc/2807 MALDI-ToF mass spectrum of polystyrene (from mnova file)
References 10.14469/hpc/2808 MALDI-ToF mass spectrum of polystyrene (raw data in zip file)
References 10.14469/hpc/2993 Executes the following search as: search.datacite.org/works?query=media:chemical\/x\-gaussian*+SubjectScheme:inchikey+subject:XZYDALXOGPZGNV-UHFFFAOYSA-M+media:chemical\/x\-mnpub*
References 10.14469/hpc/2994 Executes the following search as: search.datacite.org/works?query=media:chemical\/x\-mnpub*
References 10.14469/hpc/3657 Article: A FAIR to remember - The benefits of findable, accessible, interoperable and re-useable data
References 10.1515/ci-2016-3-408 InChI As a Research Data Management Tool

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