UK Catalysis Hub Data Objects

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Repository (79)
358 data objects found

Data objects
Name: Reductive site-selective atypical C,Z-type / N2–C2 cleavage allows C-terminal protein amidation Date: 2022-04-12 00:00:00 UTC
Description: Raw data used in the publication "Reductive site-selective atypical C,Z-type / N2–C2 cleavage ...
DOI: 10.5281/zenodo.5736482.svg Location: https://zenodo.org/records/5736482
Article: Reductive site-selective atypical <i>C</i> , <i>Z</i> -type/N2-C2 cleavage allows C-terminal protein amidation
Name: Palladium-doped hierarchical ZSM-5 for catalytic selective oxidation of allylic and benzylic alcohols - Supporting Information Date: 2021-10-20 00:00:00 UTC
Description: Supplementary data to article
DOI: Location: https://royalsocietypublishing.org/doi/suppl/10.1098/rsos.211086
Article: Palladium-doped hierarchical ZSM-5 for catalytic selective oxidation of allylic and benzylic alcohols
Name: Free energy for drug-protein binding from human-guided atomistic simulations in virtual reality - Supplementary Files Date: 2022-06-18 00:00:00 UTC
Description: iMD-VR trajectories, narupa inputs, system parameters, and umbrella sampling data. Information a...
DOI: 10.5281/zenodo.6659616.svg Location: https://zenodo.org/records/6659616
Article: Free energy along drug-protein binding pathways interactively sampled in virtual reality
Name: DLSR datasets Date: 2020-11-20 00:00:00 UTC
Description: Simulated and experimental xrd-ct datasets used for the Topas implementation of the DLSR algorithm
DOI: 10.5281/zenodo.4059828 Location: https://zenodo.org/record/4059828
Article: DLSR: a solution to the parallax artefact in X-ray diffraction computed tomography data
Name: Cycling Rate-Induced Spatially-Resolved Heterogeneities in Commercial Cylindrical Li-Ion Batteries: Datasets Date: 2021-09-16 00:00:00 UTC
Description: Sinogram XRD-CT data used in the manuscript entitled "Cycling Rate-Induced Spatially-Resolved He...
DOI: 10.5281/zenodo.5172980 Location: https://zenodo.org/record/5172980
Article: Cycling Rate‐Induced Spatially‐Resolved Heterogeneities in Commercial Cylindrical Li‐Ion Batteries
Name: CCDC 2311960: Experimental Crystal Structure Determination CSD Entry: MOLCEZ Date: 2023-12-04 00:00:00 UTC
Description: MOLCEZ : catena-[(μ-2,2-[ethane-1,2-diylbis(azanylylidenemethanylylidene)]bis[6-(2-methoxyethox...
DOI: 10.5517/ccdc.csd.cc2hlsc8 Location: https://www.ccdc.cam.ac.uk/structures/Search?Ccdcid=2311960
Article: Quantifying CO<sub>2</sub> Insertion Equilibria for Low-Pressure Propene Oxide and Carbon Dioxide Ring Opening Copolymerization Catalysts
Name: CCDC 2311959: Experimental Crystal Structure Determination CSD Entry: MOLCAV Date: 2023-12-04 00:00:00 UTC
Description: MOLCAV : (μ-2,2-[ethane-1,2-diylbis(azanylylidenemethanylylidene)]bis[6-(2-methoxyethoxy)phenol...
DOI: 10.5517/ccdc.csd.cc2hlsb7 Location: https://www.ccdc.cam.ac.uk/structures/Search?Ccdcid=2311959
Article: Quantifying CO<sub>2</sub> Insertion Equilibria for Low-Pressure Propene Oxide and Carbon Dioxide Ring Opening Copolymerization Catalysts
Name: CCDC 2311958: Experimental Crystal Structure Determination CSD Entry: MOLBUO Date: 2023-12-04 00:00:00 UTC
Description: MOLBUO : catena-[(μ-2,2-[ethane-1,2-diylbis(azanylylidenemethanylylidene)]bis[6-(2-methoxyethox...
DOI: 10.5517/ccdc.csd.cc2hls96 Location: https://www.ccdc.cam.ac.uk/structures/Search?Ccdcid=2311958
Article: Quantifying CO<sub>2</sub> Insertion Equilibria for Low-Pressure Propene Oxide and Carbon Dioxide Ring Opening Copolymerization Catalysts
Name: CCDC 2237331: Experimental Crystal Structure Determination Date: 2023-01-20 00:00:00 UTC
Description: Yanhui Guo, Ili Zulkifly, Jennifer Soderman, Andrey V. Protchenko, Eugene L. Kolychev, M. Ángel...
DOI: 10.5517/ccdc.csd.cc2f33zn Location: https://www.ccdc.cam.ac.uk/structures/Search?Ccdcid=2237331
Article: Torsional Control of Frustrated Lewis Pair Behaviour Involving PNP‐type Phosphines
Name: CCDC 2237330: Experimental Crystal Structure Determination Date: 2023-01-20 00:00:00 UTC
Description: Yanhui Guo, Ili Zulkifly, Jennifer Soderman, Andrey V. Protchenko, Eugene L. Kolychev, M. Ángel...
DOI: 10.5517/ccdc.csd.cc2f33ym Location: https://www.ccdc.cam.ac.uk/structures/Search?Ccdcid=2237330
Article: Torsional Control of Frustrated Lewis Pair Behaviour Involving PNP‐type Phosphines
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 79
Average: 15.15
Maximum: 353
Minimum: 1
Groups Data objects
1-5 59
6-10 7
11-15 3
more than 20 10
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Data object groups
Group Data objects
Compressed file [zip] 14
Crystal structure [cif/pdbe] 436
Dataset 117
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
Peer Review Information for Methanol-to-Olefins Studied by UV Raman Spectroscopy as Compared to Visible Wavelength Capitalisation on Resonance Enhancement Transparent Peer Review report available (PDF)... 2024
Supplementary information for Methanol-to-Olefins Studied by UV Raman Spectroscopy as Compared to Visible WavelengthCapitalisation on Resonance Enhancement Additional information regarding absorbance bands assigned in literature... 2024
Supporting Information Active and highly durable supported catalysts for proton exchange membrane electrolysers Electronic Supl. Material (ESI) for EES Catalysis.... 2024
Supplementary Information Non-PGM Hollow Fibre-Based After-treatment for Emission Control under Real Diesel Engine Exhaust Gas Conditions Appendix A. Supl. data Word document (4MB) Multimedia component 1. ... 2024
Supporting Information Precious Metal Free Hydrogen Evolution Catalyst Design and Application Catalyst names, activity metrics, mass loadings, and other data, associa... 2024
Supporting Information: Controlled Carbon Dioxide Terpolymerizations to Deliver Toughened Yet Recyclable Thermoplastics Experimental and instrument details, polymer synthesis, characterization... 2024
Electronic Supporting Information (ESI) Structural Selectivity of Supported Pd Nanoparticles: Selective Ethanol Ammoxidation to Acetonitrile Electronic Supl. Material (ESI) for EES Catalysis.... 2024
calculation of Keq Spreadsheet detailing the calculation of Keq (XLSX)... 2024
Supporting Information Quantifying CO2 Insertion Equilibria For Low Pressure Propene Oxide and Carbon Dioxide Ring Opening Copolymerization Catalysts Characterization data of catalysts (1D and 2D NMR spectra, infrared spec... 2024
Athavan_AppliedPhysicsLetters2024 Copies of coordinate files (in xyz format) for the calculated structure Copies of coordinate files (in xyz format) for the calculated structure... 2024

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