UK Catalysis Hub Data Objects

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436 data objects found

Data objects
Name: Crystal structure of KPC-4 complexed with relebactam (1 hour soak) Date: 2019-09-23 00:00:00 UTC
Description: Crystal structure of KPC-4 complexed with relebactam (1 hour soak)
DOI: 10.2210/pdb6qwc/pdb Location: https://www.rcsb.org/structure/6qwc
Article: Molecular Basis of Class A β-Lactamase Inhibition by Relebactam
Name: Crystal structure of KPC-3 Date: 2019-09-23 00:00:00 UTC
Description: Crystal structure of KPC-3
DOI: 10.2210/pdb6qwd/pdb Location: https://www.rcsb.org/structure/6qwd
Article: Molecular Basis of Class A β-Lactamase Inhibition by Relebactam
Name: Crystal structure of KPC-4 Date: 2019-09-23 00:00:00 UTC
Description: Crystal structure of KPC-4
DOI: 10.2210/pdb6qwe/pdb Location: https://www.rcsb.org/structure/6qwe
Article: Molecular Basis of Class A β-Lactamase Inhibition by Relebactam
Name: Evolution of a computationally designed Kemp eliminase Date: 2019-07-08 00:00:00 UTC
Description: Evolution of a computationally designed Kemp eliminase
DOI: 10.2210/pdb6nw4/pdb Location: https://www.rcsb.org/structure/6nw4
Article: Emergence of a Negative Activation Heat Capacity during Evolution of a Designed Enzyme
Name: CCDC 1580495: Experimental Crystal Structure Determination Date: 2018-01-01 00:00:00 UTC
Description: Related Article: Catherine Weetman, Stuart Notman, Polly L. Arnold|2018|Dalton Trans.|47|2568|do...
DOI: 10.5517/ccdc.csd.cc1q1mq3 Location: http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc1q1mq3&sid=DataCite
Article: Destruction of chemical warfare agent simulants by air and moisture stable metal NHC complexes
Name: CCDC 1856101: Experimental Crystal Structure Determination Date: 2018-01-01 00:00:00 UTC
Description: Related Article: Polly Arnold, Ryan Kerr, Catherine Weetman, Scott Doherty, Julia Rieb, Kai Wang...
DOI: 10.5517/ccdc.csd.cc209f70 Location: http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc209f70&sid=DataCite
Article: Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes
Name: CCDC 1856102: Experimental Crystal Structure Determination Date: 2018-01-01 00:00:00 UTC
Description: Related Article: Polly Arnold, Ryan Kerr, Catherine Weetman, Scott Doherty, Julia Rieb, Kai Wang...
DOI: 10.5517/ccdc.csd.cc209f81 Location: http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc209f81&sid=DataCite
Article: Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes
Name: CCDC 1856103: Experimental Crystal Structure Determination Date: 2018-01-01 00:00:00 UTC
Description: Related Article: Polly Arnold, Ryan Kerr, Catherine Weetman, Scott Doherty, Julia Rieb, Kai Wang...
DOI: 10.5517/ccdc.csd.cc209f92 Location: http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc209f92&sid=DataCite
Article: Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes
Name: CCDC 1856104: Experimental Crystal Structure Determination Date: 2018-01-01 00:00:00 UTC
Description: Related Article: Polly Arnold, Ryan Kerr, Catherine Weetman, Scott Doherty, Julia Rieb, Kai Wang...
DOI: 10.5517/ccdc.csd.cc209fb3 Location: http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc209fb3&sid=DataCite
Article: Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes
Name: CCDC 1856105: Experimental Crystal Structure Determination Date: 2018-01-01 00:00:00 UTC
Description: Related Article: Polly Arnold, Ryan Kerr, Catherine Weetman, Scott Doherty, Julia Rieb, Kai Wang...
DOI: 10.5517/ccdc.csd.cc209fc4 Location: http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc209fc4&sid=DataCite
Article: Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes
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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