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
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Name: GC Raw Data from Transition metal chalcogenide bifunctional catalysts for chemical recycling by plastic hydrocracking: a single-source precursor approach Date: 2022-01-01 00:00:00 UTC
Description: Transition metal chalcogenide bifunctional catalysts for chemical recycling by plastic hydrocrac...
DOI: 10.6084/m9.figshare.19330498
Location: https://rs.figshare.com/articles/journal_contribution/GC_Raw_Data_from_Transition_metal_chalcogenide_bifunctional_catalysts_for_chemical_recycling_by_plastic_hydrocracking_a_single-source_precursor_approach/19330498
Article: Transition metal chalcogenide bifunctional catalysts for chemical recycling by plastic hydrocracking: a single-source precursor approach
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Name: GT-Predict Date: 2018-11-12 00:00:00 UTC
Description: We utilized informatics and machine learning to build predictive software for enzyme functional ...
DOI: 10.5287/bodleian:zg5195kae
Location: https://ora.ox.ac.uk/objects/uuid:1b174bc0-4058-4057-8db4-59872c2b6d99
Article: Functional and informatics analysis enables glycosyltransferase activity prediction
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Name: Glycerol carboxylation over biochar - Data.xlsx Date: 2020-08-17 00:00:00 UTC
Description: Related Article: Collett, Catherine, Mašek, Ondřej, Razali, Nurul, McGregor, James(2020) Influen...
DOI:
Location: https://drive.google.com/file/d/1PFCb2zhIgaVr8MUmXf2B-qibfDHXE58N/view?usp=sharing
Article: Influence of Biochar Composition and Source Material on Catalytic Performance: The Carboxylation of Glycerol with CO2 as a Case Study
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Name: H2 production by the photocatalytic reforming of cellulose and raw biomass using Ni, Pd, Pt and Au on titania Date: 2016-07-01 00:00:00 UTC
Description: A method has been developed for sustainable hydrogen production using sunlight and biomass. It i...
DOI: 10.17035/d.2016.0011488532
Location: https://research.cardiff.ac.uk/converis/portal/detail/Dataset/11488532?auxfun=&lang=en_GB
Article: H2 production by the photocatalytic reforming of cellulose and raw biomass using Ni, Pd, Pt and Au on titania
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Name: High - I onic - S trength W astewater T reatment via C atalytic W et O xidation over MnCeO x C atalyst Electronic Supplementary Information (ESI) Date: 2022-06-13 00:00:00 UTC
Description: Control experiments of phenol oxidation; catalyst characterizations; carbon balance; effect of i...
DOI:
Location: https://pubs.acs.org/doi/suppl/10.1021/acscatal.2c01952/suppl_file/cs2c01952_si_001.pdf
Article: High-Ionic-Strength Wastewater Treatment via Catalytic Wet Oxidation over a MnCeO<sub><i>x</i></sub> Catalyst
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Name: How bulk and surface properties of Ti4SiC3, V4SiC3, Nb4SiC3 and Zr4SiC3 tune reactivity: a computational study - data Date: 2021-01-01 00:00:00 UTC
Description: The bulk and surface properties of early transition metal silicon carbides as well as their acti...
DOI: 10.17035/d.2021.0128671491
Location: https://research.cardiff.ac.uk/converis/portal/detail/Dataset/128671491?auxfun=&lang=en_GB
Article: How bulk and surface properties of Ti4SiC3, V4SiC3, Nb4SiC3 and Zr4SiC3 tune reactivity: a computational study
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Name: INS Studies of Olefin Reactivity in HZSM-5 Zeolite Catalysts Date: 2022-03-24 00:00:00 UTC
Description: This proposal looks at the reactivity of propene in a commercial ZSM-5 zeolite catalyst. It buil...
DOI: 10.5286/isis.e.101133845
Location: https://data.isis.stfc.ac.uk/doi/study/101225098
Article: Studies of propene conversion over H-ZSM-5 demonstrate the importance of propene as an intermediate in methanol-to-hydrocarbons chemistry
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Name: INS Studies of Olefin Reactivity in HZSM-5 Zeolite Catalysts. (March 2019) Date: 2019-03-01 00:00:00 UTC
Description: This proposal looks at the reactivity of propene in a commercial ZSM-5 zeolite catalyst. It buil...
DOI: 10.5286/isis.e.rb1910203
Location: https://data.isis.stfc.ac.uk/doi/STUDY/101225098/
Article: The application of neutron scattering to investigate hydrocarbon conversion over zeolite catalysts.
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Name: INS studies of the interaction of propene with ZSM-5. (December 2017) Date: 2017-12-01 00:00:00 UTC
Description: Fluidised Catalytic Cracking (FCC) units are one of the major conversion units in modern petroch...
DOI: 10.5286/isis.e.rb1720047
Location: https://data.isis.stfc.ac.uk/doi/STUDY/103201534/
Article: The application of neutron scattering to investigate hydrocarbon conversion over zeolite catalysts.
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