UK Catalysis Hub Data Objects

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Repository (78)
16 data objects found

Data objects
Name: AAC.00564-19-s0001.pdf Date: 2019-09-23 00:00:00 UTC
Description: Supplementary data for Molecular Basis of Class A β-Lactamase Inhibition by Relebactam
DOI: Location: https://aac.asm.org/content/aac/suppl/2019/09/12/AAC.00564-19.DCSupplemental/AAC.00564-19-s0001.pdf
Article: Molecular Basis of Class A β-Lactamase Inhibition by Relebactam
Name: Additional data supporting the publication of: Small bite-angle phosphinophosphinine ligands enable rhodium catalysed hydroboration of carbonyls Date: 2018-01-01 00:00:00 UTC
Description: Two zip files containing NMR spectroscopy and mass spectrometry data.
DOI: 10.17861/14c23fe6-bc65-4806-ba5e-63642a6ad3e9 Location: https://pureapps2.hw.ac.uk/portal/en/datasets/additional-data-supporting-the-publication-of-small-biteangle-phosphinophosphinine-ligands-enable-rhodium-catalysed-hydroboration-of-carbonyls(14c23fe6-bc65-4806-ba5e-63642a6ad3e9).html
Article: Small bite-angle 2-phosphinophosphinine ligands enable rhodium-catalysed hydroboration of carbonyls
Name: Enlighten2 Python package Date: 2020-10-15 00:00:00 UTC
Description: The source code for the Enlighten2 Python package and the Dockerfile used to create the Docker i...
DOI: Location: https://github.com/vanderkamp/enlighten2
Article: Enlighten2: molecular dynamics simulations of protein–ligand systems made accessible
Name: Enlighten2 source code Date: 2020-10-15 00:00:00 UTC
Description: The code for the plugin is available as a separate GitHub repository
DOI: Location: https://github.com/vanderkamp/enlighten2-pymol
Article: Enlighten2: molecular dynamics simulations of protein–ligand systems made accessible
Name: LanCL Date: 2021-05-12 00:00:00 UTC
Description: Mass spectrometry and Western blot data supporting the function of LanCL proteins published in C...
DOI: 10.17632/sgjzwcxgsr.1 Location: https://data.mendeley.com/datasets/sgjzwcxgsr/1
Article: LanCLs add glutathione to dehydroamino acids generated at phosphorylated sites in the proteome
Name: SD2I Date: 2023-05-15 00:00:00 UTC
Description: The Single Digit to Image (SD2I) tensorflow-based image reconstruction tool.
DOI: Location: https://github.com/robindong3/SD2I
Article: A scalable neural network architecture for self-supervised tomographic image reconstruction
Name: Supplementary Information for: Counting the acid sites in a commercial ZSM-5 zeolite catalyst Date: 2022-11-01 00:00:00 UTC
Description: Supplementary data to article
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acsphyschemau.2c00040/suppl_file/pg2c00040_si_001.pdf
Article: Counting the Acid Sites in a Commercial ZSM-5 Zeolite Catalyst
Name: Supporting Information for Mechanistic Insight into Molecular Crystalline Organometallic Heterogeneous Catalysis Through Parahydrogen Based Nuclear Magnetic Resonance Studies Date: 2023-01-23 00:00:00 UTC
Description: Supplementary data to article
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/jacs.2c12642/suppl_file/ja2c12642_si_001.pdf
Article: Mechanistic Insights into Molecular Crystalline Organometallic Heterogeneous Catalysis through Parahydrogen-Based Nuclear Magnetic Resonance Studies
Name: Supporting Information: Adsorbate-Induced Structural Evolution of Pd Catalyst for the Selective Hydrogenation of Acetylene Date: 2022-12-07 00:00:00 UTC
Description: Supplementary data to article
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acscatal.0c03897/suppl_file/cs0c03897_si_001.pdf
Article: Adsorbate-Induced Structural Evolution of Pd Catalyst for Selective Hydrogenation of Acetylene
Name: Supporting information for: Resolving the effect of oxygen vacancies on Co nanostructures using soft XAS/X-PEEM Date: 2022-07-14 00:00:00 UTC
Description: Supplementary data to article
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acscatal.2c00611/suppl_file/cs2c00611_si_001.pdf
Article: Resolving the Effect of Oxygen Vacancies on Co Nanostructures Using Soft XAS/X-PEEM
Data objects per year
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Data objects accumulated vs. per year
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Data objects per repository
Repository Data objects
https://www.ccdc.cam.ac.uk 353
https://pubs.acs.org 173
https://www.rsc.org 153
https://static-content.springer.com 92
https://ars.els-cdn.com 64
https://chemistry-europe.onlinelibrary.wiley.com 55
https://onlinelibrary.wiley.com 36
https://data.isis.stfc.ac.uk 33
https://www.rcsb.org 27
https://www.nature.com 22
Summary
Repositories 78
Average: 15.47
Maximum: 353
Minimum: 1
Groups Data objects
1-5 57
6-10 7
11-15 4
more than 20 10
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Data object groups
Group Data objects
Compressed file [zip] 14
Crystal structure [cif/pdbe] 436
Dataset 127
Document [pdf/html/docx/ppt] 589
Media File (image/video) 28
Software [app/api/service/source code] 7
xyz 6
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Recent data objects
Name Description Publised
LaMnO3 catalytic behaviour Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
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Pt3Sn nanoparticle electrocatalysts Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
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N2O decomposition on LaMnO3 Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
MoOx/Al2O3 Cyclic Operation Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
Ultra-dilute Au colloids Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
Diphosphine ligands in iron Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
Palladium-Catalyzed CO Oxidation Galaxy RO Crate object containing the workflow and data with the reprodu... 2024

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