Research data supporting 'Rapid Route-Finding for Bifurcating Organic Reactions'

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dc.contributor.authorLee, Sanha
dc.contributor.authorGoodman, Jonathan
dc.date.accessioned2022-06-07T15:53:06Z
dc.date.available2022-06-07T15:53:06Z
dc.identifier.urihttps://www.repository.cam.ac.uk/handle/1810/337880
dc.descriptionThis dataset contains: - Cartesian coordinates of all the optimised structures in the publication. Please see README document for more detailed information
dc.description.sponsorshipWe are grateful to Trinity College, University of Cambridge for the financial support for this research.
dc.formatValleyRidge.py is available from Github link: https://github.com/sanha0213/ValleyRidge
dc.rightsAttribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)
dc.rights.urihttps://creativecommons.org/licenses/by-nc-sa/4.0/
dc.subjectBifurcating Reactions
dc.subjectAutomatic Selectivity Prediction
dc.subjectValleyRidge.py
dc.titleResearch data supporting 'Rapid Route-Finding for Bifurcating Organic Reactions'
dc.typeDataset
dc.publisher.departmentDepartment of Chemistry Student
dc.date.updated2022-04-14T23:41:28Z
dc.identifier.doi10.17863/CAM.83551
rioxxterms.licenseref.urihttps://creativecommons.org/licenses/by-nc-sa/4.0/
datacite.contributor.supervisorGoodman, Jonathan M
dcterms.formatpdf
dc.contributor.orcidLee, Sanha [0000-0002-3940-0939]
dc.contributor.orcidGoodman, Jonathan [0000-0002-8693-9136]
rioxxterms.typeOther
datacite.issupplementto.doihttps://dx.doi.org/10.1021/jacs.9b13449
datacite.issupplementto.urlhttps://www.repository.cam.ac.uk/handle/1810/304812
cam.depositDate2022-04-15
pubs.licence-identifierapollo-deposit-licence-2-1
pubs.licence-display-nameApollo Repository Deposit Licence Agreement


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Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)
Except where otherwise noted, this item's licence is described as Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)