Natural & Computing Sciences

  • AB24 3UE

Research Output 1972 2020

2019

Investigating the role of band offset on the property and op-eration of the potential well barrier diodes

Akura, M. & Dunn, G., May 2019, In : physica status solidi (c). 256, 5, 1800284.

Research output: Contribution to journalArticle

diodes
heterojunctions
coefficients
aluminum gallium arsenides
space charge

Investigation of Penicillin Binding Protein (PBP)-like Peptide Cyclase and Hydrolase in Surugamide Non-ribosomal Peptide Biosynthesis

Zhou, Y., Lin, X., Xu, C., Shen, Y., Wang, S-P., Liao, H., Li, L., Deng, H. & Lin, H-W., 16 May 2019, In : Cell chemical biology. 26, 5, p. 737-744 8 p.

Research output: Contribution to journalArticle

Nucleic Acid-Independent Peptide Biosynthesis
Peptide Synthases
Penicillin-Binding Proteins
Peptide Hydrolases
Cyclic Peptides
1 Citation (Scopus)
4 Downloads (Pure)

Investigation of ZSM-5 catalysts for dimethylether conversion using inelastic neutron scattering

Zachariou, A., Hawkins, A., Lennon, D., Parker, S. F., Suwardiyanto, Matam, S. K., Catlow, C. R. A., Collier, P., Hameed, A., McGregor, J. & Howe, R. F., 5 Jan 2019, In : Applied Catalysis A: General. 569, p. 1-7 7 p.

Research output: Contribution to journalArticle

Open Access
File
Inelastic neutron scattering
Catalysts
Hydrocarbons
Coke
Methanol

In vitro reconstitution of the biosynthetic pathway of 3-hydroxypicolinic acid

Yun, X., Zhang, Q., Lv, M., Deng, H., Deng, Z. & Yu, Y., 21 Jan 2019, In : Organic & Biomolecular Chemistry. 17, 3, p. 454-460 7 p.

Research output: Contribution to journalArticle

Biosynthetic Pathways
acids
Hydroxylation
Metabolites
dimethylaniline monooxygenase (N-oxide forming)
4 Citations (Scopus)

Iron-based photocatalytic and photoelectrocatalytic nano-structures: Facts, perspectives, and expectations

AlSalka, Y., Granone, L. I., Ramadan, W., Hakki, A., Dillert, R. & Bahnemann, D. W., 5 May 2019, In : Applied Catalysis B: Environmental. 244, p. 1065-1095 31 p.

Research output: Contribution to journalArticle

Iron
iron
Photocatalysis
Photocatalysts
Nanostructures

Knowledge Driven Intelligent Survey Systems Towards Open Science

Edelstein, E., Pan, J. Z., Soares, R. & Wyner, A., 25 Jul 2019, (Accepted/In press) In : New Generation Computing.

Research output: Contribution to journalArticle

Open systems
Open Systems
Linguistics
Semantics
Graph in graph theory
2 Downloads (Pure)

Knowledge-driven stock trend prediction and explanation via temporal convolutional network

Deng, S., Zhang, N., Zhang, W., Chen, J., Pan, J. Z. & Chen, H., 13 May 2019, Companion Proceedings of the 2019 World Wide Web Conference (WWW ’19 Companion). Liu, L. & White, R. (eds.). New York: Association for Computing Machinery, Inc, p. 678-685 8 p.

Research output: Chapter in Book/Report/Conference proceedingConference contribution

Open Access
File
Experiments
Deep neural networks

Latent Space Factorisation and Manipulation via Matrix Subspace Projection

Li, X., Lin, C., Wang, C. & Guerin, F., 26 Jul 2019, (Submitted) ArXiv, 10 p.

Research output: Working paper

Factorization

LatinPSO: An algorithm for simultaneously inferring structure and parameters of ordinary differential equations models

Tian, X., Pang, W., Wang, Y., Guo, K. & Zhou, Y., Aug 2019, In : BioSystems. 182, p. 8-16 9 p.

Research output: Contribution to journalArticle

Ordinary differential equations
Ordinary differential equation
HIV
Latin Hypercube Sampling
Identification Problem
1 Citation (Scopus)

LC-HRMS-Database Screening Metrics for Rapid Prioritization of Samples to Accelerate the Discovery of Structurally New Natural Products

Tabudravu, J. N., Pellissier, L., Smith, A. J., Subko, K., Autréau, C., Feussner, K., Hardy, D., Butler, D., Kidd, R., Milton, E. J., Deng, H., Ebel, R., Salonna, M., Gissi, C., Montesanto, F., Kelly, S. M., Milne, B. F., Cimpan, G. & Jaspars, M., 2019, In : Journal of Natural Products. 82, 2, p. 211-220 10 p.

Research output: Contribution to journalArticle

Fiji
Urochordata
Workflow
Porifera
Biological Products

Legonoxamines A-B, two new hydroxamate siderophores from the soil bacterium, Streptomyces sp. MA37

Maglangit, F., Tong, M. H., Jaspars, M., Kyeremeh, K. & Deng, H., 3 Jan 2019, In : Tetrahedron Letters. 60, 1, p. 75-79 5 p.

Research output: Contribution to journalArticle

Siderophores
Streptomyces
Bacteria
Soil
Soils
Open Access
File
Museums
Spectrometry
Precipitates
Color
Liquids
1 Citation (Scopus)
4 Downloads (Pure)

LiSEQ – whole-genome sequencing of a cross-sectional survey of Listeria monocytogenes in ready-to-eat foods and human clinical cases in Europe

Painset, A., Björkman, J. T., Kiil, K., Guillier, L., Mariet, J-F., Félix, B., Amar, C., Rotariu, O., Roussel, S., Perez-Reche, F., Brisse, S., Moura, A., Lecuit, M., Forbes, K., Strachan, N., Grant, K., Møller-Nielsen, E. & Dallman, T. J., Feb 2019, In : Microbial Genomics. 5, 2, 11 p., 000257.

Research output: Contribution to journalArticle

Open Access
File
Listeria
Listeria monocytogenes
Cross-Sectional Studies
Genome
Food

Low-temperature studies of propene oligomerization in ZSM-5 by inelastic neutron scattering spectroscopy

Hawkins, A. P., Zachariou, A., Collier, P., Ewings, R. A., Howe, R. F., Parker, S. F. & Lennon, D., 14 Jun 2019, In : RSC Advances. 9, 33, p. 18785-18790 6 p.

Research output: Contribution to journalArticle

Open Access
File
Zeolites
Oligomerization
Inelastic neutron scattering
Propylene
Spectroscopy
1 Citation (Scopus)
5 Downloads (Pure)

Lyapunov analysis of multiscale dynamics: the slow bundle of the two-scale Lorenz 96 model

Carlu, M., Ginelli, F., Lucarini, V. & Politi, A., 7 May 2019, In : Nonlinear Processes in Geophysics. 26, 2, p. 73-89 17 p.

Research output: Contribution to journalArticle

Open Access
File
bundles
degrees of freedom
ensemble forecasting
Climate models
climate models

Making Effective Use of Healthcare Data Using Data-to-Text Technology

Pauws, S., Gatt, A., Krahmer, E. & Reiter, E., 22 Mar 2019, Data Science for Healthcare: Methodologies and Applications. Consoli, S., Recupero, D. R. & Petkovic, M. (eds.). Springer , p. 119-145 27 p. 4

Research output: Chapter in Book/Report/Conference proceedingChapter (peer-reviewed)

Technology
Delivery of Health Care
Organizations
Patient Transfer
Artificial Intelligence
Ferrosoferric Oxide
Inductively coupled plasma mass spectrometry
Transmission Electron Microscopy
Light scattering
Nanoparticles

Minimal primal ideals in the inner corona algebra of a C_{0}(X)-algebra

Archbold, R. J. & Somerset, D. W. B., 24 Jan 2019, (Accepted/In press) In : Houston Journal of Mathematics.

Research output: Contribution to journalArticle

Corona
Equivalence relation
Closed
Algebra
Extremally Disconnected

Mobilisation of arsenic, selenium and uranium from Carboniferous black shales in west Ireland

Armstrong, J. G. T., Parnell, J., Bullock, L. A., Boyce, A. J., Perez, M. & Feldmann, J., 14 Aug 2019, In : Applied Geochemistry. 109, 104401.

Research output: Contribution to journalArticle

Open Access
File
Uranium
Selenium
Trace Elements
Arsenic
Trace elements
7 Citations (Scopus)
Hexanes
Chain length
curvature
synthesis
Liquid Crystals

Morita Invariance of Equivariant Lusternik-Schnirelmann Category and Invariant Topological Complexity

Angel, A., Colman, H., Grant, M. & Oprea, J., 14 Aug 2019, (Submitted) ArXiv, 14 p.

Research output: Working paper

Lusternik-Schnirelmann Category
Topological Complexity
Equivariant
Morita Equivalence
Invariance
5 Citations (Scopus)
4 Downloads (Pure)

Multi-level chirality in liquid crystals formed by achiral molecules

Salamończyk, M., Vaupotič, N., Pociecha, D., Walker, R., Storey, J. M. D., Imrie, C. T., Wang, C., Zhu, C. & Gorecka, E., 23 Apr 2019, In : Nature Communications. 10, 1922.

Research output: Contribution to journalArticle

Open Access
File
Liquid Crystals
Chirality
chirality
Nucleic Acids
Theoretical Models
8 Citations (Scopus)

Multiple strategies to decrease ignition temperature for soot combustion on ultrathin MnO2- x nanosheet array

Shi, Q., Liu, T., Li, Q., Xin, Y., Lu, X., Tang, W., Zhang, Z., Gao, P. X. & Anderson, J. A., 5 Jun 2019, In : Applied Catalysis B: Environmental. 246, p. 312-321 10 p.

Research output: Contribution to journalArticle

Soot
Nanosheets
soot
Ignition
combustion
1 Citation (Scopus)

Multiplex Limited Penetrable Horizontal Visibility Graph from EEG Signals for Driver Fatigue Detection

Cai, Q., Gao, Z-K., Yang, Y-X., Dang, W-D. & Grebogi, C., 1 Jun 2019, In : International Journal of Neural Systems. 29, 5, 1850057.

Research output: Contribution to journalArticle

Electroencephalography
Visibility
Fatigue of materials
Brain
Highway accidents
1 Downloads (Pure)
Open Access
File
Campylobacter jejuni
Fluoroquinolones
Aminoglycosides
Poultry
Campylobacter coli
4 Downloads (Pure)

Non-existence of Hopf orders for a twist of the alternating and symmetric groups

Cuadra, J. & Meir, E., Aug 2019, In : Journal of the London Mathematical Society. 100, 1, p. 137-158 22 p.

Research output: Contribution to journalArticle

Open Access
File
Alternating group
Hopf Algebra
Symmetric group
Twist
Nonexistence
1 Citation (Scopus)

Novel electrochemical nanoswitch biosensor based on self-assembled pH-sensitive continuous circular DNA

Chen, X., Yao, L., Wang, Y. C., Chen, Q., Deng, H., Lin, Z. Y. & Yang, H. H., 15 Apr 2019, In : Biosensors and Bioelectronics. 131, p. 274-279 6 p.

Research output: Contribution to journalArticle

Circular DNA
Biosensing Techniques
MicroRNAs
Biosensors
DNA
2 Citations (Scopus)

Novel non-targeted analysis of perfluorinated compounds using fluorine-specific detection regardless of their ionisability (HPLC-ICPMS/MS-ESI-MS)

Azua Jamari, N. L., Dohmann, J. F., Raab, A., Krupp, E. M. & Feldmann, J., 11 Apr 2019, In : Analytica Chimica Acta. 1053, p. 22-31 10 p.

Research output: Contribution to journalArticle

Fluorine Compounds
Inductively coupled plasma mass spectrometry
Electrospray Ionization Mass Spectrometry
fluorine
Tandem Mass Spectrometry
Open Access
File
Computational chemistry
computational chemistry
Surface analysis
Crystal structure
chemistry
4 Downloads (Pure)

On the Möbius Function and Topology of General Pattern Posets

Smith, J. P., 22 Mar 2019, In : Electronic Journal of Combinatorics. 26, 1, p. 1.49

Research output: Contribution to journalArticle

Open Access
File
Poset
Topology
M-function
Fibration
Shellability
5 Downloads (Pure)

On Unipotent Radicals of Pseudo-Reductive Groups

Bate, M., Martin, B., Röhrle, G. & Stewart, D. I., 1 Jun 2019, In : The Michigan Mathematical Journal. 68, 2, p. 277-299 23 p.

Research output: Contribution to journalArticle

Open Access
File
Reductive Group
K-group
Scalar
Nilpotency
Closure
4 Downloads (Pure)

Orbit Closures and Invariants

Bate, M., Geranios, H. & Martin, B., 23 Jan 2019, In : Mathematische Zeitschrift. 39 p.

Research output: Contribution to journalArticle

Open Access
File
Closure
Orbit
Subgroup
Invariant
If and only if

Perfect Isometries Between Blocks of Complex Reflection Groups

Brunat, O. & Gramain, J-B., 15 May 2019, In : Journal of Algebra.

Research output: Contribution to journalArticle

Complex Reflection Groups
Isometric
Isometry
Integer
2 Downloads (Pure)

Permutation entropy revisited

Watt, S. J. & Politi, A., 1 Mar 2019, In : Chaos, Solitons & Fractals. 120, p. 95-99 5 p.

Research output: Contribution to journalArticle

Permutation
Entropy
Partition
Nonlinear Time Series Analysis
Time Series Analysis
1 Downloads (Pure)

Permutation Graphs and the Abelian Sandpile Model, Tiered Trees and Non-Ambiguous Binary Trees

Dukes, M., Selig, T., Smith, J. P. & Steingrimsson, E., 16 Aug 2019, In : Electronic Journal of Combinatorics. 26, 3, P3.29.

Research output: Contribution to journalArticle

Open Access
File
Permutation Graphs
Sandpile Model
Binary trees
Binary Tree
Bijection
3 Citations (Scopus)

Photocatalytic Concrete for NOx Abatement: Supported TiO2 efficiencies and impacts

Yang, L., Hakki, A., Zheng, L., Jones, M. R., Wang, F. & MacPhee, D. E., 1 Feb 2019, In : Cement and Concrete Research. 116, p. 57-64 8 p.

Research output: Contribution to journalArticle

Mortar
Concretes
Photocatalysts
Environmental Pollutants
Catalysts
5 Downloads (Pure)

Photocatalytic Functionalized Aggregate: Enhanced Concrete Performance in Environmental Remediation

Hakki, A., Yang, L., Wang, F., Elhoweris, A., Alhorr, Y. & MacPhee, D., 1 Feb 2019, In : Buildings. 9, 2, 10 p., 28.

Research output: Contribution to journalArticle

Open Access
File
Photocatalysts
Concretes
Mortar
Catalyst supports
Silicon Dioxide

Policies to Regulate Distributed Data Exchange

Cauvin, S. R., Oren, N. & Vasconcelos, W. W., 2019, Agreement Technologies: 6th International Conference, AT 2018, Bergen, Norway, December 6-7, 2018, Revised Selected Papers. Lujak, M. (ed.). Cham: Springer , p. 146-161 16 p. (Lecture Notes in Computer Science; vol. 11327).

Research output: Chapter in Book/Report/Conference proceedingConference contribution

Electronic data interchange
Experiments
Compliance

Potential photoacid generators based on oxime sulfonates

Plater, M. J., Harrison, W. T. A. & Killah, R., 13 May 2019, In : Journal of Chemical Research. 43, 1-2, p. 26-33 9 p.

Research output: Contribution to journalArticle

Open Access
File
Oximes
Chlorides
Acids
Methylene Chloride
Electric lamps
1 Citation (Scopus)
6 Downloads (Pure)

Prioritized norms in formal argumentation

Liao, B., Oren, N., Torre, L. V. D. & Villata, S., Mar 2019, In : Journal of Logic and Computation. 29, 2, p. 215-240 26 p.

Research output: Contribution to journalArticle

Open Access
File
Argumentation
Norm
Reasoning
Nonmonotonic Logic
Optimization
Open Access
File
Transparency
Information management
Internet of things
Sensors
protected area
naturalness
public spending
mental health
ecological impact
10 Downloads (Pure)

Quantitative assessment of cerebral connectivity deficiency and cognitive impairment in children with prenatal alcohol exposure

Gao, L., Grebogi, C., Lai, Y-C., Stephen, J., Zhang, T., Li, Y., Ren, H., Li, D., Wang, J., Schelter, B. & Sommerlade, L., Apr 2019, In : Chaos. 29, 4, 041101 .

Research output: Contribution to journalArticle

Open Access
File
impairment
Alcohol
Connectivity
alcohols
Alcohols

Recording Provenance of Food Delivery Using IoT, Semantics and Business Blockchain Networks

Markovic, M., Edwards, P. & Jacobs, N., 20 Aug 2019, (Accepted/In press) Proceedings of the 6th IEEE International Conference on Internet of Things: Systems, Management and Security. IEEE Explore

Research output: Chapter in Book/Report/Conference proceedingConference contribution

2 Citations (Scopus)

Relative Commutant Pictures of Roe Algebras

Spakula, J. & Tikuisis, A. P., Feb 2019, In : Communications in Mathematical Physics. 365, 3, p. 1019-1048 30 p.

Research output: Contribution to journalArticle

Commutant
algebra
operators
Algebra
Operator

Relevance search over schema-rich knowledge graphs

Gu, Y., Li, Z., Zhou, T., Pan, J. Z., Cheng, G. & Qu, Y., 30 Jan 2019, WSDM 2019 - Proceedings of the 12th ACM International Conference on Web Search and Data Mining. Association for Computing Machinery, Inc, p. 114-122 9 p.

Research output: Chapter in Book/Report/Conference proceedingConference contribution

Semantics
Scalability
Experiments

Rigidity and exotic models for v1-local G-equivariant stable homotopy

Patchkoria, I. & Roitzheim, C., 12 Aug 2019, In : Mathematische Zeitschrift.

Research output: Contribution to journalArticle

Open Access
Stable Homotopy
Equivariant
Rigidity
Model
Local Spectrum

Seaweed fertilisation impacts the chemical and isotopic composition of barley: Implications for analyses of archaeological skeletal remains

Blanz, M., Ascough, P., Mainland, I., Martin, P., Taggart, M. A., Dieterich, B., Wishart, J., Sayle, K. L., Raab, A. & Feldmann, J., Apr 2019, In : Journal of Archaeological Science. 104, p. 34-44 11 p.

Research output: Contribution to journalArticle

agricultural product
reconstruction
animal
interpretation
Barley
2 Citations (Scopus)
5 Downloads (Pure)

Selenium and tellurium concentrations of Carboniferous British coals

Bullock, L. A., Parnell, J., Feldmann, J., Armstrong, J. G., Henn, A. S., Mesko, M. F., Mello, P. A. & Flores, E. M. M., 31 May 2019, In : Geological Journal. 54, 3, p. 1401-1412 12 p.

Research output: Contribution to journalArticle

Open Access
File
tellurium
selenium
coal
pyrite
trace element
2 Citations (Scopus)
3 Downloads (Pure)

Self-adaptation of chimera states

Yao, N., Huang, Z-G., Ren, H. P., Grebogi, C. & Lai, Y-C., Jan 2019, In : Physical Review. E, Statistical, Nonlinear and Soft Matter Physics. 99, 1, 6 p., 010201(R).

Research output: Contribution to journalArticle

Open Access
File
Self-adaptation
Perturbation
perturbation
Robustness
Optimal Location