Chemistry

Search results

• Alpha-Galactosaminidase family GH114 protein from Environmental sample (99.2% identity to Myxococcus fulvus enzyme): X-ray diffraction images

  Roth, C. (Creator), Moroz, O. V. (Creator), Miranda, S. A. D. (Creator), Jahn, L. (Creator), Blagova, E. (Creator), Lebedev, A. A. (Creator), Segura, D. R. (Creator), Stringer, M. A. (Creator), Friis, E. P. (Creator), Davies, G. J. (Creator) & Wilson, K. S. (Creator), Zenodo, 31 Dec 2024

  DOI: 10.5281/zenodo.10936960

  Dataset

• DFT study of the ring opening of cyclohexene oxide by an aminophosphonium salt

  Buchard, A. P. (Creator), Clark, E. F. (Creator), Dunstan, E. (Creator) & Kociok-Kohn, G. (Creator), figshare, 27 Nov 2024

  DOI: 10.6084/m9.figshare.26487826

  Dataset

• Macromolecular refinement by model morphing using non-atomic parameterizations

  Cowtan, K. D. (Creator), University of York, 24 Jul 2017

  DOI: 10.15124/0dd39199-299c-433e-a29b-1f83a6273fb2

  Dataset

• Competing pathways in the photochemistry of Ru(H)2(CO)(PPh3)3

  Perutz, R. N. (Creator), Duckett, S. (Creator) & Procacci, B. (Creator), University of York, 2018

  DOI: 10.15124/0c09438d-5132-4264-9ecb-b88b94bf8193

  Dataset

• Robust comparison of climate models with observations using blended land air and ocean sea surface temperatures

  Cowtan, K. D. (Creator), University of York, 13 Aug 2015

  DOI: 10.15124/19d249ab-1463-4d13-ade7-86f645de833b, http://www-users.york.ac.uk/~kdc3/papers/robust2015/

  Dataset

• Comparison of automated crystallographic model building pipelines

  Alharbi, E. M. R. (Creator), Cowtan, K. D. (Supervisor) & Calinescu, R. C. (Supervisor), University of York, 31 Oct 2019

  DOI: 10.15124/d4cb35df-a42d-4365-b539-9868730d165f, https://webfiles.york.ac.uk/INFODATA/d4cb35df-a42d-4365-b539-9868730d165f and one more link, https://creativecommons.org/licenses/by/4.0/ (show fewer)

  Dataset

• Data and methods for "Comment on `The impact of recent forcing and ocean heat uptake data on estimates of climate sensitivity'"

  Cowtan, K. D. (Creator), University of York, 2018

  DOI: 10.15124/92466e73-6012-4ab4-ad10-cd7fdc075cb3, https://webfiles.york.ac.uk/INFODATA/92466e73-6012-4ab4-ad10-cd7fdc075cb3 and one more link, https://creativecommons.org/licenses/by/4.0/ (show fewer)

  Dataset

• Data from the paper "Shape segregation in molecular organisation: a combined X-ray scattering and molecular dynamics study of smectic liquid crystals"

  Sims, M. T. (Creator), Abbott, L. C. (Contributor), Goodby, J. W. (Contributor) & Moore, J. (Supervisor), University of York, 2019

  DOI: 10.15124/42e530cf-ca08-40ce-b182-cdeefe317801

  Dataset

• Dataset for A comprehensive understanding of carbon-carbon bond formation by alkyne migratory insertion into manganacycles

  Lynam, J. M. (Creator), University of York, 19 Jul 2022

  DOI: 10.15124/8ccc891d-15a5-4a79-986b-6d20b3777d59

  Dataset

• Dataset for the paper: ModelCraft: an advanced automated model-building pipeline using Buccaneer

  Bond, P. (Creator), Zenodo, 18 Jul 2022

  DOI: 10.5281/zenodo.6856249

  Dataset

• Data from the paper "Dyes in liquid crystals: experimental and computational studies of a guest-host system based on a combined DFT and MD approach"

  Moore, J. (Supervisor), Sims, M. T. (Creator), Abbott, L. C. (Contributor), Cowling, S. J. (Contributor) & Goodby, J. W. (Supervisor), University of York, 2015

  DOI: 10.15124/72d38707-9c5f-4169-8dee-a1887c3412d2

  Dataset

• Dataset to accompany publication "Harnessing Glycofluoroforms for Impedimetric Biosensing"

  Parkin, A. (Creator), Hewson, A. (Creator), Fascione, M. A. (Creator), Keenan, T. (Creator) & Signoret, N. Y. M. (Creator), University of York, 1 Aug 2024

  DOI: 10.15124/7d29d86e-ce9a-46d1-b00f-d76f388b57e2

  Dataset

• H2ICE NOx emissions data for Webster et al paper

  Lewis, A. (Creator) & Moller, S. J. (Contributor), University of York, 23 Jul 2024

  DOI: 10.15124/1211f7cd-b707-43ba-9a91-69f3f515a587

  Dataset

• Data for paper: Solvent responsive catalyst improves NMR sensitivity via efficient magnetisation transfer

  Duckett, S. B. (Creator) & Ruddlesden, A. J. (Data Collector), University of York, 15 Jun 2016

  DOI: 10.15124/cdaf969f-ba47-401e-876b-512c0cece55c

  Dataset

• Dataset for "The impact of surfaces on indoor air chemistry following cooking and cleaning"

  Davies, H. (Creator), Harding-Smith, E. (Contributor), O'Leary, C. A. (Contributor), Winkless, R. (Contributor), Shaw, M. D. (Contributor), Dillon, T. J. (Contributor), Jones, B. (Contributor) & Carslaw, N. (Contributor), University of York, 23 Aug 2024

  DOI: 10.15124/f6598a1a-2f7e-4235-aa2c-98cb9a9607f3

  Dataset

• The electro-photonic silicon biosensor: supporting dataset

  Juan Colás, J. (Creator), Parkin, A. (Supervisor), Dunn, K. (Contributor), Scullion, M. G. (Contributor), Krauss, T. F. (Supervisor) & Johnson, S. D. (Supervisor), University of York, 2016

  DOI: 10.15124/419c1760-fd74-4046-ba90-fb53710430f3

  Dataset

• Dataset for Yearlong study of indoor VOC variability: Insights into spatial, temporal, and contextual dynamics of indoor VOC exposure

  Warburton, T. (Creator) & Shaw, D. (Other), University of York, 18 Feb 2025

  DOI: 10.15124/24fd1762-0e98-4773-a74c-7dd87ef59aa8

  Dataset

• Photochemical Pump and NMR Probe to monitor the formation and kinetics of hyperpolarized metal dihydrides

  Perutz, R. N. (Creator), Procacci, B. (Creator), Halse, M. E. (Creator), Duckett, S. (Creator) & Aguiar, P. M. (Creator), University of York, 9 Aug 2016

  DOI: 10.15124/282717d1-d7d9-428f-8b77-b98b6a8b6f80

  Dataset

• Updated restraint dictionaries for carbohydrates in the pyranose form

  Atanasova, M. (Creator), Nicholls, R. A. (Creator), Joosten, R. (Creator) & Agirre, J. (Creator), Zenodo, 12 Aug 2021

  DOI: 10.5281/zenodo.5186777

  Dataset

• Diffraction images used to solve the structures published in the article "Structure of human endo-α-1,2-mannosidase (MANEA), an antiviral host-glycosylation target"

  Sobala, L. F. (Creator), Thompson, A. J. (Creator), Davies, G. J. (Creator), Fernandes, P. Z. (Contributor), Hakki, Z. (Contributor), Howe, J. D. (Contributor), Hill, M. (Contributor), Zitzmann, N. (Contributor), Davies, S. (Contributor), Stamataki, Z. (Contributor), Butters, T. D. (Contributor), Alonzi, D. S. (Contributor) & Williams, S. J. (Contributor), Zenodo, 1 Jan 2021

  DOI: 10.5281/zenodo.4288342

  Dataset

• Very Short Lived Halocarbons (VSLH) Air and Seawater Data. Version 1.0

  Carpenter, L. (Creator), Andrews, S. (Creator) & Lidster, R. (Creator), UCAR/NCAR - Earth Observing Laboratory, 20 May 2013

  DOI: 10.26023/t7ve-3z2a-450t

  Dataset

• QUANT: A Three-Year, Multi-City Air Quality Dataset of Commercial Air Sensors and Reference Data for Performance Evaluation

  Diez, S. (Creator), Lacy, S. (Creator), Pete, E. (Creator), Read, K. A. (Creator) & Josefina, U. (Creator), Zenodo, 2 Mar 2024

  DOI: 10.5281/zenodo.10775692

  Dataset

• Data from: Reconciling diverse viewpoints within systematic conservation planning

  Cunningham, C. (Creator), Crick, H. (Creator), Morecroft, M. (Creator), Thomas, C. (Creator) & Beale, C. (Creator), Dryad, 26 Jan 2023

  DOI: 10.5061/dryad.dr7sqvb2w

  Dataset

• Code and data for 'Human modification of land cover alters net primary productivity, species richness and their relationship' manuscript

  Deng, S. (Creator), Beale, C. M. (Creator), Platts, P. (Creator) & Thomas, C. (Creator), Zenodo, 1 Dec 2023

  DOI: 10.5281/zenodo.10245343, https://zenodo.org10245343

  Dataset

• Code and data for 'Human modification of land cover alters net primary productivity, species richness and their relationship' manuscript

  Deng, S. (Creator), Beale, C. M. (Creator), Platts, P. (Creator) & Thomas, C. (Creator), Zenodo, 11 Dec 2023

  DOI: 10.5281/zenodo.10356475

  Dataset