UK Catalysis Hub Data Objects

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Data object type (1)
Repository (78)
6 data objects found

Data objects
Name: Computational data for "Artificial Metalloenzymes as Catalysts for Oxidative Lignin Degradation" Date: 2018-10-10 00:00:00 UTC
Description: Data and metadata for the MD simulations included in the paper\nM. V. Doble, A. G. Jarvis, A. C....
DOI: 10.17630/259AFFA7-75AE-495F-8D2A-7D9742D3EF13 Location: https://risweb.st-andrews.ac.uk:443/portal/en/datasets/computational-data-for-artificial-metalloenzymes-as-catalysts-for-oxidative-lignin-degradation(259affa7-75ae-495f-8d2a-7d9742d3ef13).html
Article: Artificial Metalloenzymes as Catalysts for Oxidative Lignin Degradation
Name: Elementary Steps in the Formation of Hydrocarbons from Surface Methoxy Groups in HZSM-5 seen by Synchrotron Infrared Microspectroscopy (dataset) Date: 2019-01-01 00:00:00 UTC
Description:
DOI: 10.17630/D0E5A924-8850-4FE4-A56F-B00C7472F25A Location: https://risweb.st-andrews.ac.uk/portal/en/datasets/elementary-steps-in-the-formation-of-hydrocarbons-from-surface-methoxy-groups-in-hzsm5-seen-by-synchrotron-infrared-microspectroscopy-dataset(d0e5a924-8850-4fe4-a56f-b00c7472f25a).html
Article: Elementary Steps in the Formation of Hydrocarbons from Surface Methoxy Groups in HZSM-5 Seen by Synchrotron Infrared Microspectroscopy
Name: Enzyme Activity by Design: An Artificial Rhodium Hydroformylase for Linear Aldehyes Date: 2017-01-01 00:00:00 UTC
Description: Data files relating to the paper ' Enzyme Activity by Design: An Artificial Rhodium Hydroformyla...
DOI: 10.17630/03FA38F2-B858-4FFF-A478-83E61672955C Location: https://risweb.st-andrews.ac.uk:443/portal/en/datasets/enzyme-activity-by-design-an-artificial-rhodium-hydroformylase-for-linear-aldehyes(03fa38f2-b858-4fff-a478-83e61672955c).html
Article: Enzyme Activity by Design: An Artificial Rhodium Hydroformylase for Linear Aldehydes
Name: Mechanism of the Catalytic Carboxylation of Alkylboronates with CO2 using Ni-NHC complexes: A DFT Study (dataset) Date: 2017-01-01 00:00:00 UTC
Description: Computational data and metadata underpinning publication in scientific journal
DOI: 10.17630/383E38EC-A571-49CA-8A54-9EBF020E4513 Location: https://risweb.st-andrews.ac.uk:443/portal/en/datasets/mechanism-of-the-catalytic-carboxylation-of-alkylboronates-with-co2-using-ninhc-complexes-a-dft-study-dataset(383e38ec-a571-49ca-8a54-9ebf020e4513).html
Article: Mechanism of the Catalytic Carboxylation of Alkylboronates with CO2 Using Ni−NHC Complexes: A DFT Study
Name: Effects of Crystal Size on Methanol to Hydrocarbon Conversion over Single Crystals of ZSM-5 Studied by Synchrotron Infrared Microspectroscopy (dataset) Date: 2020-01-01 00:00:00 UTC
Description: The following file types and formats are included: - Sample characterisation files (X-ray diffra...
DOI: 10.17630/306BD3C3-014B-466F-9538-B107628C847D Location: https://risweb.st-andrews.ac.uk/portal/en/datasets/effects-of-crystal-size-on-methanol-to-hydrocarbon-conversion-over-single-crystals-of-zsm5-studied-by-synchrotron-infrared-microspectroscopy-dataset(306bd3c3-014b-466f-9538-b107628c847d).html
Article: Effects of crystal size on methanol to hydrocarbon conversion over single crystals of ZSM-5 studied by synchrotron infrared microspectroscopy
Name: Carbene-like Reactivity of Methoxy Groups in a Single Crystal SAPO 34 MTO Catalyst (dataset) Date: 2022-03-04 00:00:00 UTC
Description: Data availabilityThe research data supporting this publication can be accessed athttps://doi.org...
DOI: 10.17630/42adc9c0-c790-4b52-9ba9-846cfdfe4da9 Location: https://risweb.st-andrews.ac.uk/portal/en/datasets/carbenelike-reactivity-of-methoxy-groups-in-a-single-crystal-sapo-34-mto-catalyst-dataset(42adc9c0-c790-4b52-9ba9-846cfdfe4da9).html
Article: Carbene-like reactivity of methoxy groups in a single crystal SAPO-34 MTO catalyst
Data objects 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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