UK Catalysis Hub Data Objects

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Repository (78)
146 data objects found

Data objects
Name: SI for: Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality Date: 2019-07-23 00:00:00 UTC
Description: Related Article: Bennie, Simon J., Ranaghan, Kara E., Deeks, Helen, Goldsmith, Heather E., O’Con...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acs.jchemed.9b00181/suppl_file/ed9b00181_si_003.pdf
Article: Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality
Name: SI for: Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality Date: 2019-07-23 00:00:00 UTC
Description: Related Article: Bennie, Simon J., Ranaghan, Kara E., Deeks, Helen, Goldsmith, Heather E., O’Con...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acs.jchemed.9b00181/suppl_file/ed9b00181_si_004.docx
Article: Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality
Name: SI: Dehydrative Etherification Reactions of Glycerol with Alcohols Catalyzed by Recyclable Nanoporous Aluminosilicates: Telescoped Routes to Glyceryl Ethers Date: 2015-11-30 00:00:00 UTC
Description: Related Article: Davies, Thomas E., Kondrat, Simon A., Nowicka, Ewa, Graham, James J., Apperley,...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acssuschemeng.5b00894/suppl_file/sc5b00894_si_001.pdf
Article: Dehydrative Etherification Reactions of Glycerol with Alcohols Catalyzed by Recyclable Nanoporous Aluminosilicates: Telescoped Routes to Glyceryl Ethers
Name: SI: Expanding Beyond the Micropore: Active-Site Engineering in Hierarchical Architectures for Beckmann Rearrangement Date: 2015-09-29 00:00:00 UTC
Description: Related Article: Newland, Stephanie H., Sinkler, Wharton, Mezza, Thomas, Bare, Simon R., Carrave...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acscatal.5b01595/suppl_file/cs5b01595_si_001.pdf
Article: Expanding Beyond the Micropore: Active-Site Engineering in Hierarchical Architectures for Beckmann Rearrangement
Name: Spatial Profiling of a Pd/Al2O3 Catalyst during Selective Ammonia Oxidation Date: 2021-02-03 00:00:00 UTC
Description: EXAFS fit results, MCR results, XANES whiteline analysis, and reactor temperature
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acscatal.0c05356/suppl_file/cs0c05356_si_001.pdf
Article: Spatial Profiling of a Pd/Al2O3 Catalyst during Selective Ammonia Oxidation
Name: Sulfated Zirconia Catalysts for D‑Sorbitol Cascade Cyclodehydration to Isosorbide: Impact of Zirconia Phase Date: 2018-10-11 00:00:00 UTC
Description: Catalyst synthesis procedure and characterization data, along with full details of catalytic rea...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acssuschemeng.8b03268/suppl_file/sc8b03268_si_001.pdf
Article: Sulfated Zirconia Catalysts for D-Sorbitol Cascade Cyclodehydration to Isosorbide: Impact of Zirconia Phase
Name: Supplementary Information The Relationship Between Mn Oxidation State Changes and Oxygen Reduction Activity in (La,Ca)MnO3 as Probed by In Situ XAS and XES Date: 2021-05-16 00:00:00 UTC
Description: Percentage of peroxide formation during the ORR; Mn XANES of references; calibration plot for th...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acscatal.1c00997/suppl_file/cs1c00997_si_001.pdf
Article: Relationship between Mn Oxidation State Changes and Oxygen Reduction Activity in (La,Ca)MnO3 as Probed by In Situ XAS and XES
Name: Supporting Information Zr(IV) Catalyst for the Ring Opening Copolymerization of Anhydrides (A) with Epoxides (B), Oxetane (B) and Tetrahydrofurans (C) to Make ABB - and/or ABC - Poly(ester - alt – ethers) Date: 2022-04-07 00:00:00 UTC
Description: Characterization data of complexes (NMR, X-ray crystallography, elemental analysis) and polymeri...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/jacs.2c01225/suppl_file/ja2c01225_si_001.pdf
Article: Zr(IV) Catalyst for the Ring-Opening Copolymerization of Anhydrides (A) with Epoxides (B), Oxetane (B), and Tetrahydrofurans (C) to Make ABB- and/or ABC-Poly(ester-<i>alt</i>-ethers)
Name: Supporting Information for Instantaneous and phosphine-catalyzed arene binding and reduction by U(III) complexes Date: 2021-03-04 00:00:00 UTC
Description: Supplementary data for Instantaneous and Phosphine-Catalyzed Arene Binding and Reduction by U(II...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acs.inorgchem.1c00327/suppl_file/ic1c00327_si_001.pdf
Article: Instantaneous and Phosphine-Catalyzed Arene Binding and Reduction by U(III) Complexes
Name: Supporting information for The Critical Role of βPdZn Alloy in Pd/ZnO Catalysts for the Hydrogenation of Carbon Dioxide to Methanol Date: 2022-04-20 00:00:00 UTC
Description: More detailed information about catalyst preparation (section 1) and characterization (section 2...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acscatal.2c00552/suppl_file/cs2c00552_si_001.pdf
Article: The Critical Role of βPdZn Alloy in Pd/ZnO Catalysts for the Hydrogenation of Carbon Dioxide to Methanol
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 344
https://pubs.acs.org 146
https://www.rsc.org 130
https://static-content.springer.com 85
https://ars.els-cdn.com 60
https://chemistry-europe.onlinelibrary.wiley.com 50
https://onlinelibrary.wiley.com 33
https://www.rcsb.org 28
https://www.nature.com 22
https://data.isis.stfc.ac.uk 19
Summary
Repositories 78
Average: 14.21
Maximum: 344
Minimum: 1
Groups Data objects
1-5 57
6-10 7
11-15 4
16-20 1
more than 20 9
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Data object groups
Group Data objects
Compressed file [zip] 11
Crystal structure [cif/pdbe] 438
Dataset 101
Document [pdf/html/docx/ppt] 518
Media File (image/video) 26
Protein Sequence 1
Software [app/api/service/source code] 7
xyz 6
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Recent data objects
Name Description Publised
41598_2023_43523_MOESM1_ESM.pdf Free energy along drug-protein binding pathways interactively sampled in... 2023
adma202302825-sup-0001-SuppMat.pdf Supporting Information for Adv. Mater., DOI 10.1002/adma.202302825... 2023
ja3c05863_si_001.pdf Supporting information: Chemical Recycling of Commercial Poly(L-lactic a... 2023
emi16488-sup-0001-Supinfo.docx Copper bioreduction and nanoparticle synthesis by an enrichment culture ... 2023
41467_2023_40284_MOESM2_ESM.pdf Peer Review File Understanding Catalytic Synergy in Dinuclear Polymeriza... 2023
41467_2023_40284_MOESM1_ESM.pdf Supl. Information Understanding Catalytic Synergy in Dinuclear Polymeriz... 2023
1-s2.0-S0021951723001677-mmc1.pdf Supporting Information Efficient low-loaded ternary Pd-In2O3-Al2O3 catal... 2023
adfm202302102-sup-0001-SuppMat.pdf Supporting Information for Adv. Funct. Mater., DOI: 10.1002/adfm.2023021... 2023
zaac202300016-sup-0001-misc_information.pdf Supporting Information Torsional Control of Frustrated Lewis Pair Behavi... 2023
jp3c00952_si_001.pdf Electronic Supl. Information (ESI) Study and modeling of the kinetics of... 2023

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