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First-principles study of electronic and optical properties in 1-dimensional oligomeric derivatives of telomestatin

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dc.contributor.authorMérgola-Greef, Joëlle
dc.contributor.authorMilne, Bruce F.
dc.contributor.institutionUniversity of Aberdeen.Natural & Computing Sciencesen
dc.contributor.institutionUniversity of Aberdeen.Chemistryen
dc.date.accessioned2023-05-17T09:53:01Z
dc.date.available2023-05-17T09:53:01Z
dc.date.issued2023-04-24
dc.descriptionOpen Access via the RSC Agreement Acknowledgements The authors acknowledge financial support from the Industrial Biotechnology Innovation Centre (IBioIC, doctoral training grant BB/W059899/1). This work was also supported by national funds from the Portuguese FCT – Fundação para a Ciência e a Tecnologia, I. P., within the projects UIDB/04564/2020 and UIDP/04564/2020. The authors thank the Laboratory for Advanced Computing (LCA) of the University of Coimbra, Portugal for technical support. The authors would also like to acknowledge the support of the Maxwell Compute Cluster funded by the University of Aberdeen. All 2D chemical structures in this work were created using Marvin version 23.1, ChemAxon (https://www.chemaxon.com).en
dc.description.statusPeer revieweden
dc.format.extent9
dc.format.extent1517258
dc.identifier240498192
dc.identifier4b91638e-bf93-4163-a548-ce17ef339bbc
dc.identifier85158837708
dc.identifier.citationMérgola-Greef, J & Milne, B F 2023, 'First-principles study of electronic and optical properties in 1-dimensional oligomeric derivatives of telomestatin', Physical Chemistry Chemical Physics, vol. 25, no. 18, pp. 12744-12753. https://doi.org/10.1039/D3CP01140Ben
dc.identifier.doi10.1039/D3CP01140B
dc.identifier.iss18en
dc.identifier.issn1463-9076
dc.identifier.otherRIS: urn:CBCA1AA19E13AA394979FAD5E2E922DE
dc.identifier.otherORCID: /0000-0002-5522-4808/work/135245062
dc.identifier.urihttps://hdl.handle.net/2164/20741
dc.identifier.vol25en
dc.language.isoeng
dc.relation.ispartofPhysical Chemistry Chemical Physicsen
dc.subjectQD Chemistryen
dc.subjectBiotechnology and Biological Sciences Research Council (BBSRC)en
dc.subjectBB/W059899/1en
dc.subjectSupplementary Informationen
dc.subject.lccQDen
dc.titleFirst-principles study of electronic and optical properties in 1-dimensional oligomeric derivatives of telomestatinen
dc.typeJournal articleen

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