Publications 2022

2022 (155 articles)

Abhijeet H. Thaker, Vivek V. Ranade, " Emulsions Using a Vortex-Based Cavitation Device: Influence of Number of Passes, Pressure Drop, and Device Scale on Droplet Size Distributions,", Industrial &amp$mathsemicolon$ Engineering Chemistry Research, , 2022 , , Source
Adarsh V. Kalikadien, Evgeny A. Pidko, Vivek Sinha, " ChemSpaX: exploration of chemical space by automated functionalization of molecular scaffold,", Digital Discovery, , 2022 , , Source
Agnes Banreti, Shayon Bhattacharya, Frank Wien, Koichi Matsuo, Matthieu Refregiers, Cornelia Meinert, Uwe Meierhenrich, Bruno Hudry, Damien Thompson, Stephane Noselli, " Biological effects of the loss of homochirality in a multicellular organism,", Nature Communications, 13, 2022 , , Source
Ahmed Ahmed, Constantinos G. Efthymiou, Rana Sanii, Ewa Patyk-Kazmierczak, Amir M. Alsharabasy, Meghan Winterlich, Naveen Kumar, Debobroto Sensharma, Wenming Tong, Sarah Guerin, Pau Farras, Sarah Hudson, Damien Thompson, Michael J. Zaworotko, Anastasios J. Tasiopoulos, Constantina Papatriantafyllopoulou, " NUIG4: A biocompatible pcu metaltextendashorganic framework with an exceptional doxorubicin encapsulation capacity,", Journal of Materials Chemistry B, 10, 2022 , 1378--1385, Source
Alessandra Logallo, Manting Mu, Max Garcia-Melchor, Eva Hevia, " Building Square Planar Cobalt (II) Complexes via Sodium Mediated Cobaltation of Fluoroarenes,", Angewandte Chemie International Edition, 61, 2022 , , Source
Alessandro Lunghi, " Toward exact predictions of spin-phonon relaxation times: An ab initio implementation of open quantum systems theory,", Science Advances, 8, 2022 , , Source
Alexsander S Wilkinson, " Illustration and Ornamentation in the Iberian Book World, 1450-1800", , book, 2022 , , Source
Ali Margot Huerta-Flores, Francisco Ruiz-Zepeda, Cavit Eyovge, Jedrzej P. Winczewski, Matthias Vandichel, Miran Gabervsvcek, Nicolas D. Boscher, Han J.G.E. Gardeniers, Leticia M. Torres-Martinez, Arturo Susarrey-Arce, " Enhanced Photocatalytic Hydrogen Evolution from Water Splitting on Ta2O5/SrZrO3 Heterostructures Decorated with uxO/RuO2 Cocatalysts,", ACS Applied Materials &amp$mathsemicolon$ Interfaces, 14, 2022 , 31767--31781, Source
A L Mesquita, D Rodgers-Lee, A A Vidotto, R D Kavanagh, " The strong suppression of galactic cosmic rays reaching AUMic, and ProxCen,", Monthly Notices of the Royal Astronomical Society, 515, 2022 , 1218--1227, Source
Anirudh Venugopal, Laurentius H. T. Egberts, Jittima Meeprasert, Evgeny A. Pidko, Bernard Dam, Thomas Burdyny, Vivek Sinha, Wilson A. Smith, " Polymer Modification of Surface Electronic Properties of Electrocatalysts,", ACS Energy Letters, 7, 2022 , 1586--1593, Source
Annabel Rae, Keelan M. Byrne, Scott A. Brown, Alan R. Kennedy, Tobias Krämer, Robert E. Mulvey, Stuart D. Robertson, " Sigma/pi Bonding Preferences of Solvated Alkali-Metal Cations to Ditopic Arylmethyl Anions,", Chemistry - A European Journal, 28, 2022 , , Source
Annika M. Krieger, Vivek Sinha, Guanna Li, Evgeny A. Pidko, " Solvent-Assisted Ketone Reduction by a Homogeneous Mn Catalyst,", Organometallics, 41, 2022 , 1829--1835, Source
Ashish Vashishtha, Snehasish Panigrahy, Dino Campi, Dean Callaghan, Cathal Nolan, Ralf Deiterding, " Oblique Detonation Wave Control with O3 and H2O2 Sensitization in Hypersonic Flow,", Energies, 15, 2022 , 4140, Source
Austin M. Cano, Suresh Kondati Natarajan, Jonathan L. Partridge, Simon D. Elliott, Steven M. George, " Spontaneous etching of B2O3 by HF gas studied using infrared spectroscopy, mass spectrometry, and density functional theory,", Journal of Vacuum Science &amp$mathsemicolon$ Technology A, 40, 2022 , 022601, Source
Azizah M. Malebari, Gabriela Duffy Morales, Brendan Twamley, Darren Fayne, Mohemmed Faraz Khan, Eavan C. McLoughlin, Niamh M. OBoyle, Daniela M. Zisterer, Mary J. Meegan, " Synthesis, Characterisation and Mechanism of Action of Anticancer 3-Fluoroazetidin-2-ones,", Pharmaceuticals, 15, 2022 , 1044, Source
Betty Y.T. Lee, Andrew D. Phillips, Muhammad Hanif, Tilo Söhnel, Christian G. Hartinger, " Triazolyl- vs Pyridyl-Functionalized $less$i$greater$N$less$/i$greater$-Heterocyclic Carbene Complexes: Impact of the Pendant N-Donor Ligand on Intramolecular CtextendashC Bond Formation,", ACS Organic &amp$mathsemicolon$ Inorganic Au, 2, 2022 , 511--524, Source
B Kerkeni, I Garcia-Bernete, D Rigopoulou, D P Tew, P F Roche, D C Clary, " Probing computational methodologies in predicting mid-infrared spectra for large polycyclic aromatic hydrocarbons,", Monthly Notices of the Royal Astronomical Society, 513, 2022 , 3663--3681, Source
Bobby Huxford, William Ronan, Benjamin P Russell, " Fibre bridging: Continuum modelling of extrinsic toughening in double cantilever beam tests,", Journal of Composite Materials, 56, 2022 , 3307--3321, Source
Bruno Ariano, Valeria Mattiangeli, Emily M. Breslin, Eoin W. Parkinson, T. Rowan McLaughlin, Jess E. Thompson, Ronika K. Power, Jay T. Stock, Bernardette Mercieca-Spiteri, Simon Stoddart, Caroline Malone, Shyam Gopalakrishnan, Lara M. Cassidy, Daniel G. Bradley, " Ancient Maltese genomes and the genetic geography of Neolithic Europe,", Current Biology, 32, 2022 , 2668--2680.e6, Source
B van~Soelen, S Mc~Keague, D Malyshev, M Chernyakova, N Komin, N Matchett, I M Monageng, " Improved binary solution for the gamma-ray binary 1FGL J1018.6-5856,", Monthly Notices of the Royal Astronomical Society, 515, 2022 , 1078--1085, Source
Cara-Lena Nies, Suresh Kondati Natarajan, Michael Nolan, " Control of the Cu morphology on Ru-passivated and Ru-doped TaN surfaces textendash promoting growth of 2D conducting copper for CMOS interconnects,", Chemical Science, 13, 2022 , 713--725, Source
Caroline Crowley, Brian Murphy, Conan McCaul, Ronan Cahill, Kevin Patrick Nolan, " Airborne particle dispersion by high flow nasal oxygen: An experimental and CFD analysis,", PLOS ONE, 17, 2022 , e0262547, Source
Caroline Crowley, Ronan Cahill, Kevin Nolan, " A CFD analysis of gas leaks and aerosol transport in laparoscopic surgery,", Physics of Fluids, 34, 2022 , 081905, Source
Cecilia Chiaracane, Archak Purkayastha, Mark T. Mitchison, John Goold, " Dephasing-enhanced performance in quasiperiodic thermal machines,", Physical Review B, 105, 2022 , , Source
Christian A. Nijhuis, Ziyu Zhang, Francis Adoah, Cameron Nickle, Senthil Kumar Karuppannan, Lejia Wang, Li Jiang, Anton Tadich, Bruce Cowie, Teddy Salim, Dong-Chen Qi, Damien Thompson, Enrique Del Barco, " Control over Molecular Orbital Gating and Marcus Inverted Charge Transport in Molecular Junctions with Conjugated Molecular Wires,", Advanced Electronic Materials, 9, 2022 , 2200637, Source
Ciaran Barron, Silas OToole, Dominic Zerulla, " Fabrication of Nanoscale Active Plasmonic Elements Using Atomic Force Microscope Tip-Based Nanomachining,", Nanomanufacturing and Metrology, 5, 2022 , 50--59, Source
Clement Calvino, Tomasz Dabrowski, Frederic Dias, " A study of the sea level and current effects on the sea state in Galway Bay, using the numerical model COAWST,", Ocean Dynamics, 72, 2022 , 761--774, Source
Clement Calvino, Tomasz Dabrowski, Frederic Dias, " Current interaction in large-scale wave models with an application to Ireland,", Continental Shelf Research, 245, 2022 , 104798, Source
Connor V. Cunnane, J. Graeme Houston, Daniel T. Moran, Stephen P. Broderick, Rose A. Ross, Michael T. Walsh, " Spiral Laminar Flow is Associated with a Reduction in Disturbed Shear in Patient-Specific Models of an Arteriovenous Fistula,", Cardiovascular Engineering and Technology, , 2022 , , Source
Constantin D. Sahm, Anna Ciotti, Eric Mates-Torres, Vivek Badiani, Kamil Sokolowski, Gaia Neri, Alexander J. Cowan, Max Garcia-Melchor, Erwin Reisner, " Tuning the local chemical environment of ZnSe quantum dots with dithiols towards photocatalytic CO$less$sub$greater$2$less$/sub$greater$ reduction,", Chemical Science, 13, 2022 , 5988--5998, Source
Daire OCarroll, Niall English, " A DFTB-Based Molecular Dynamics Investigation of an Explicitly Solvated Anatase Nanoparticle,", Applied Sciences, 12, 2022 , 780, Source
Daniel C. Najera, Marconi N. Pe~nas-Defrutos, Max Garcia-Melchor, Alison R. Fout, " γ-Agostic interactions in (MesCCC)Fe–Mes(L) complexes,", Chemical Communications, 58, 2022 , 9626--9629, Source
D. Chaudhuri, C. H. Patterson, " TDDFT versus $less$i$greater$GW$less$/i$greater$/BSE Methods for Prediction of Light Absorption and Emission in a TADF Emitter,", The Journal of Physical Chemistry A, 126, 2022 , 9627--9643, Source
Debobroto Sensharma, Daniel J. OtextquotesingleHearn, Amin Koochaki, Andrey A. Bezrukov, Naveen Kumar, Benjamin H. Wilson, Matthias Vandichel, Michael J. Zaworotko, " The First Sulfate-Pillared Hybrid Ultramicroporous Material, SOFOUR-1-Zn, and Its Acetylene Capture Properties,", Angewandte Chemie International Edition, , 2022 , , Source
DJordje Dangic, Stephen Fahy, Ivana Savic, " Molecular dynamics simulation of the ferroelectric phase transition in GeTe: Displacive or order-disorder character,", Physical Review B, 106, 2022 , , Source
Dualta O Fionnagain, Robert D. Kavanagh, Aline A. Vidotto, Sandra V. Jeffers, Pascal Petit, Stephen Marsden, Julien Morin, Aaron Golden, " Coronal Mass Ejections and Type II Radio Emission Variability during a Magnetic Cycle on the Solar-type Star ϵ Eridani,", The Astrophysical Journal, 924, 2022 , 115, Source
Eavan C. McLoughlin, John E. OtextquotesingleBrien, Cristina Trujillo, Mary J. Meegan, Niamh M. OtextquotesingleBoyle, " Application of 2D EXSY and qNMR Spectroscopy for Diastereomeric Excess Determination Following Chiral Resolution of $upbeta$-Lactams,", ChemistryOpen, , 2022 , , Source
Edgar Galvan, Leonardo Trujillo, Fergal Stapleton, " Semantics in Multi-objective Genetic Programming,", Applied Soft Computing, 115, 2022 , 108143, Source
Edmund Gilbert, Ashwini Shanmugam, Gianpiero L. Cavalleri, " Revealing the recent demographic history of Europe via haplotype sharing in the UK Biobank,", Proceedings of the National Academy of Sciences, 119, 2022 , , Source
Eoin H. Oude Essink, Tim Persoons, Gordon OtextquotesingleBrien, Sajad Alimohammadi, " Numerical Investigation of Adjustable Air Amplifiers as an Alternative to Fans in Data Centre Servers,", 2022 21st IEEE Intersociety Conference on Thermal and Thermomechanical Phenomena in Electronic Systems (iTherm), book, 2022 , , Source
Eoin H. Oude Essink, Tim Persoons, Sajad Alimohammadi, " Parametric Investigation of Inlet Pressure and Diffuser Angle Impact on Adjustable Air Amplifier Performance,", 2022 28th International Workshop on Thermal Investigations of ICs and Systems (THERMINIC), book, 2022 , , Source
Farhan S.M. Ali, Ryan Lacdao Arevalo, Matthias Vandichel, Florian Speck, Eeva-Leena Rautama, Hua Jiang, Olli Sorsa, Kimmo Mustonen, Serhiy Cherevko, Tanja Kallio, " Hydrogen evolution in alkaline medium on intratube and surface decorated PtRu catalyst,", Applied Catalysis B: Environmental, 315, 2022 , 121541, Source
Fergal Stapleton, Edgar Galvan, Ganesh Sistu, Senthil Yogamani, " Neuroevolutionary multi-objective approaches to trajectory prediction in autonomous vehicles,", Proceedings of the Genetic and Evolutionary Computation Conference Companion, book, 2022 , , Source
Frederik Claeye, Yosra Boughattas, Erno T. Tornikoski, " Formation of Social Entrepreneurial Intention: A Qualitative Grounded Approach at the Base of the Pyramid,", Administrative Sciences, 12, 2022 , 24, Source
G. Aarts, C. Allton, J. Glesaaen, S. Hands, B. Jäger, S. Kim, M.hspace0.167emP. Lombardo, A.hspace0.167emA. Nikolaev, S.hspace0.167emM. Ryan, J.-I. Skullerud, L.-K. Wu, " Properties of the QCD thermal transition with ", Physical Review D, 105, 2022 , , Source
G. Aarts, C. Allton, S. Hands, B. Jäger, S. Kim, M. P. Lombardo, A.A. Nikolaev, S. M. Ryan, J.-I. Skullerud, " Lattice QCD at nonzero temperature and density,", Journal of Physics: Conference Series, 2207, 2022 , 012055, Source
Ganesh Babu, Ramchandra Cheke, Ganesh Sistu, Senthil Yogamani, " Multi-lane modelling using convolutional neural networks and conditional random fields,", Electronic Imaging, 34, 2022 , 148--1--148--6, Source
Gerard Pareras, Silvia Simon, Albert Poater, Miquel Sol`a, " Successive DielstextendashAlder Cycloadditions of Cyclopentadiene to [10]CPP$supset$C$less$sub$greater$60$less$/sub$greater$: A Computational Study,", The Journal of Organic Chemistry, 87, 2022 , 5149--5157, Source
Grazia Cottone, Letizia Chiodo, Luca Maragliano, Michel-Robert Popoff, Christine Rasetti-Escargueil, Emmanuel Lemichez, Ther`ese E. Malliavin, " In Silico Conformational Features of Botulinum Toxins A1 and E1 According to Intraluminal Acidification,", Toxins, 14, 2022 , 644, Source
Guillermo Marcos-Ayuso, Marconi N. Pe~nas-Defrutos, Ana M. Gallego, Max Garcia-Melchor, Jesus M. Martinez-Ilarduya, Pablo Espinet, " Problematic Ar$less$sup$greater$F$less$/sup$greater$textendashAlkynyl Coupling with Fluorinated Aryls. From Partial Success with Alkynyl Stannanes to Efficient Solutions via Mechanistic Understanding of the Hidden Complexity,", Journal of the American Chemical Society, 145, 2022 , 527--536, Source
HaoLun Wu, Mohammad Reza Ghaani, Prithwish K. Nandi, Niall J. English, " Investigation of Dipolar Response of the Hydrated Hen-Egg White Lysozyme Complex under Externally Applied Electric Fields: Insights from Non-equilibrium Molecular Dynamics,", The Journal of Physical Chemistry B, , 2022 , , Source
Ibon Alkorta, Rosa M. Claramunt, Jose Elguero, Enrique Gutierrez-Puebla, M. Angeles Monge, Felipe Reviriego, Christian Roussel, " Study of the Addition Mechanism of 1$less$i$greater$H$less$/i$greater$-Indazole and Its 4-, 5-, 6-, and 7-Nitro Derivatives to Formaldehyde in Aqueous Hydrochloric Acid Solutions,", The Journal of Organic Chemistry, 87, 2022 , 5866--5881, Source
Inigo Iribarren, Cristina Trujillo, " Efficiency and Suitability when Exploring the Conformational Space of Phase-Transfer Catalysts,", Journal of Chemical Information and Modeling, 62, 2022 , 5568--5580, Source
Inigo Iribarren, Marianne Rica Garcia, Cristina Trujillo, " Catalyst design within asymmetric organocatalysis,", WIREs Computational Molecular Science, , 2022 , , Source
I. Ponomarev, T. Polcar, P. Nicolini, " New Reactive Force Field for Simulations of Mo2 Crystallization,", The Journal of Physical Chemistry C, 126, 2022 , 9475--9481, Source
Iseult Jackson, Valeria Mattiangeli, Lara M. Cassidy, Eileen Murphy, Daniel G. Bradley, " Millennium-old pathogenic Mendelian mutation discovery for multiple osteochondromas from a Gaelic Medieval graveyard,", European Journal of Human Genetics, 31, 2022 , 248--251, Source
James Nelson, Luuk Coopmans, Graham Kells, Stefano Sanvito, " Data-driven time propagation of quantum systems with neural networks,", Physical Review B, 106, 2022 , , Source
J.G. Acheson, E.A. Gallagher, J. Ward, S. McKillop, B. FitzGibbon, A.R. Boyd, B.J. Meenan, P. Lemoine, J.P. McGarry, " Shear testing and failure modelling of calcium phosphate coated AZ31 magnesium alloys for orthopaedic applications,", Surface and Coatings Technology, 429, 2022 , 127944, Source
Jiahao Zhang, Sarah Guerin, Haoran Wu, Bin Xue, Yi Cao, Syed A. M. Tofail, Yancheng Wang, Damien Thompson, Wei Wang, Kai Tao, Deqing Mei, Ehud Gazit, " Modulating vectored non-covalent interactions for layered assembly with engineerable properties,", Bio-Design and Manufacturing, 5, 2022 , 529--539, Source
Ji Liu, Hongliang Lu, David Wei Zhang, Michael Nolan, " Self-limiting nitrogen/hydrogen plasma radical chemistry in plasma-enhanced atomic layer deposition of cobalt,", Nanoscale, 14, 2022 , 4712--4725, Source
John F. Gallagher, Niall Hehir, Pavle Mocilac, Chloe Violin, Brendan F. OConnor, Emmanuel Aubert, Enrique Espinosa, Benoit Guillot, Christian Jelsch, " Probing the Electronic Properties and Interaction Landscapes in a Series of N-(Chlorophenyl)pyridinecarboxamides,", Crystal Growth & Design, 22, 2022 , 3343--3358, Source
John M. Simmie, " C2H5NO Isomers: From Acetamide to 1,2-Oxazetidine and Beyond,", The Journal of Physical Chemistry A, 126, 2022 , 924--939, Source
John V. Ringwood, Andrei Ermakov, " Energy-Maximising Control Philosophy for a Cyclorotor Wave Energy Device,", Volume 8: Ocean Renewable Energy, book, 2022 , , Source
Jose Angel Martinez-Gonzalez, Prithwish K. Nandi, Niall J. English, Aoife Gowen, " Vibrational Analysis of Hydration-Layer Water around Ubiquitin, Unpeeled Layer by Layer: Molecular-Dynamics Perceptions,", International Journal of Molecular Sciences, 23, 2022 , 15949, Source
Joshua M. McMahon, Emmanouil Kioupakis, Stefan Schulz, " Atomistic analysis of Auger recombination in ", Physical Review B, 105, 2022 , , Source
J. Subbotina, V. Lobanski, "Multiscale Modeling of Bio-Nano Interactions of Zero-Valent Silver Nanoparticles ", Journal of Physical Chemistry B, , 2022 , , Source
Julia Savioli, Graeme W. Watson, " Defect chemistry of LaGaO3 doped with divalent cations,", Solid State Ionics, 374, 2022 , 115828, Source
Julie Roste, Oskar A. Landgren, " Impacts of dynamical downscaling on circulation type statistics in the Euro-CORDEX ensemble,", Climate Dynamics, 59, 2022 , 2445--2466, Source
Ketan Madane, Chirag Khalde, Ajinkya Pandit, Vivek Ranade, " Flow Physics of Planar Bistable Fluidic Oscillator with Backflow Limbs,", AIChE Journal, , 2022 , , Source
Lamis Alaa Eldin Refat, Ciaran OMalley, John M. Simmie, Patrick McArdle, Andrea Erxleben, " Differences in Coformer Interactions of the 2,4-Diaminopyrimidines Pyrimethamine and Trimethoprim,", Crystal Growth &amp$mathsemicolon$ Design, 22, 2022 , 3163--3173, Source
Lasith Niroshan, James D. Carswell, " Post-analysis of OSM-GAN Spatial Change Detection,", Web and Wireless Geographical Information Systems, book, 2022 , 28--42, Source
Leah Webster, Tobias Krämer, F. Mark Chadwick, " Synthesis and reactivity of titanium `POCOP pincer complexes,", Dalton Transactions, 51, 2022 , 16714--16722, Source
Leticia B. Pereira, Victor Marques de Oliveira Gambarini, Alexandre Barretto de Menezes, Laura M. M. Ottoboni, Renato Vicentini, " Influence of Sugarcane Variety on Rhizosphere Microbiota Under Irrigated and Water-Limiting Conditions,", Current Microbiology, 79, 2022 , , Source
Licheng Zhu, Daniel McCrum, Jennifer Keenahan, " Capability analysis of computational fluid dynamics models in wind shield study on Queensferry Crossing, Scotland,", Proceedings of the Institution of Civil Engineers - Bridge Engineering, , 2022 , 1--13, Source
Luke A. Marchetti, Tobias Krämer, Robert B. P. Elmes, " Amidosquaramides textendash a new anion binding motif with pH sensitive anion transport properties,", Organic & Biomolecular Chemistry, 20, 2022 , 7056--7066, Source
Mahdi Tavakol, Ted J. Vaughan, " Energy dissipation of osteopontin at a HAp mineral interface: Implications for bone biomechanics,", Biophysical Journal, 121, 2022 , 228--236, Source
Manik Kumer Ghosh, Sarah N. Elliott, Kieran P. Somers, Stephen J. Klippenstein, Henry J. Curran, " Group additivity values for the heat of formation of C2textendashC8 alkanes, alkyl hydroperoxides, and their radicals,", Combustion and Flame, , 2022 , 112492, Source
Manik Kumer Ghosh, Snehasish Panigrahy, Shijun Dong, Sarah N. Elliott, Stephen J. Klippenstein, Henry J. Curran, " The influence of thermochemistry on the reactivity of propane, the pentane isomers and n-heptane in the low temperature regime,", Proceedings of the Combustion Institute, , 2022 , , Source
Manuel Fernandez-Urrutia, Artur Gil, " Resource Communication: ForestAz - Using Google Earth Engine and Sentinel data for forest monitoring in the Azores Islands (Portugal),", Forest Systems, 31, 2022 , eRC01, Source
Marco Lauricella, Mohammad Reza Ghaani, Prithwish K. Nandi, Simone Meloni, Bjorn Kvamme, and Niall J. English, "Double Life of Methanol: Experimental Studies and Nonequilibrium Molecular-Dynamics Simulation of Methanol Effects on Methane-Hydrate Nucleation", J. Phys. Chem. C, 126, 2022 , 6075–6081, Source
Marie-Isabelle Muninger, Dominik Mahr, Wafa Hammedi, " Social media use: A review of innovation management practices,", Journal of Business Research, 143, 2022 , 140--156, Source
Mark T. Mitchison, Archak Purkayastha, Marlon Brenes, Alessandro Silva, John Goold, " Taking the temperature of a pure quantum state,", Physical Review A, 105, 2022 , , Source
M.A. Rodriguez-Olguin, C. Flox, R. Ponce-Perez, R. Lipin, F. Ruiz-Zepeda, J.P. Winczewski, T. Kallio, M. Vandichel, J. Guerrero-Sanchez, J.G.E. Gardeniers, N. Takeuchi, A. Susarrey-Arce, " Chlorine in NiO promotes electroreduction of CO2 to formate,", Applied Materials Today, 28, 2022 , 101528, Source
Martina Bernini, Monika Colombo, Craig Dunlop, Rudolf Hellmuth, Claudio Chiastra, William Ronan, Ted J. Vaughan, " Oversizing of self-expanding Nitinol vascular stents textendash A biomechanical investigation in the superficial femoral artery,", Journal of the Mechanical Behavior of Biomedical Materials, 132, 2022 , 105259, Source
Matteo Cobelli, Paddy Cahalane, Stefano Sanvito, " Local inversion of the chemical environment representations,", Physical Review B, 106, 2022 , , Source
Maxime Ferrer, Ibon Alkorta, Jose Elguero, Josep M. Oliva-Enrich, " Use of 5,10-Disubstituted Dibenzoazaborines and Dibenzophosphaborines as Cyclic Supports of Frustrated Lewis Pairs for the Capture of CO", ChemPhysChem, 23, 2022 , , Source
M. Domina, M. Cobelli, S. Sanvito, " Spectral neighbor representation for vector fields: Machine learning potentials including spin,", Physical Review B, 105, 2022 , , Source
Mehdi Tavakol, Ted Vaughan, " The role of the osteocalcin-osteopontin protein complex in bone biomechanics: a key contributor to energy dissipation at mineral-mineral interfaces,", Biophysical Journal, 121, 2022 , 332a, Source
Mei-Yan Gao, Debobroto Sensharma, Andrey A. Bezrukov, Yassin H. Andaloussi, Shaza Darwish, Chenghua Deng, Matthias Vandichel, Jian Zhang, Michael J. Zaworotko, " A Robust Molecular Porous Material for C", Small, , 2022 , 2206945, Source
Michele Dully, Shayon Bhattacharya, Vivek Verma, David Murray, Damien Thompson, Tewfik Soulimane, Sarah P. Hudson, " Balanced lipase interactions for degradation-controlled paclitaxel release from lipid cubic phase formulations,", Journal of Colloid and Interface Science, 607, 2022 , 978--991, Source
Miljan Davsic, Ilia Ponomarev, Tomas Polcar, Paolo Nicolini, " Tribological properties of vanadium oxides investigated with reactive molecular dynamics,", Tribology International, 175, 2022 , 107795, Source
Mohammad Noor-A-Alam, Michael Nolan, " Large piezoelectric response in ferroelectric/multiferroelectric metal oxyhalide MOX$less$sub$greater$2$less$/sub$greater$ (M ", Nanoscale, 14, 2022 , 11676--11683, Source
Mohammad Noor-A-Alam, Michael Nolan, " Negative Piezoelectric Coefficient in Ferromagnetic 1H-LaBr2 Monolayer,", ACS Applied Electronic Materials, , 2022 , , Source
Mohammadreza Kadivar, David Tormey, Gerard McGranaghan, " CFD of roughness effects on laminar heat transfer applied to additive manufactured minichannels,", Heat and Mass Transfer, , 2022 , , Source
Mohammadreza Kadivar, David Tormey, Gerard McGranaghan, " The impact of roughness parameters on laminar convective heat transfer applied to additive manufactured minichannels,", 2022 28th International Workshop on Thermal Investigations of ICs and Systems (THERMINIC), book, 2022 , , Source
Mohsen H. Moghimi, Nathan J. Quinlan, " Application of finite volume particle method for axisymmetric modeling of droplet formation in dripping and Rayleigh regimes,", Computers & Fluids, 236, 2022 , 105321, Source
Nickolas Gantzler, Min-Bum Kim, Alexander Robinson, Maxwell W. Terban, Sanjit Ghose, Robert E. Dinnebier, Arthur Henry York, Davide Tiana, Cory M. Simon, Praveen K. Thallapally, " Computation-informed optimization of Ni(PyC)2 functionalization for noble gas separations,", Cell Reports Physical Science, 3, 2022 , 101025, Source
Nikolina Stipanivcev, Konstantin Raabe, Isabel Rozas, " Aiming to improve binding of porphyrin diphenyl guanidinium conjugates to guanine-quadruplexes: When size matters,", Bioorganic &amp$mathsemicolon$ Medicinal Chemistry Letters, 75, 2022 , 128954, Source
Nina C Georgoulea, Stephen R Power, Nuala M Caffrey, " Strain-induced stacking transition in bilayer graphene,", Journal of Physics: Condensed Matter, 34, 2022 , 475302, Source
Nirod Kumar Sarangi, Amrutha Prabhakaran, Tia E. Keyes, " Multimodal Investigation into the Interaction of Quinacrine with Microcavity-Supported Lipid Bilayers,", Langmuir, 38, 2022 , 6411--6424, Source
Nived Vilangot~Nhalil, Juie Shetye, J Gerry Doyle, " Detection of spicules termed rapid blueshifted excursions as seen in the chromosphere via Ha and the transition region via Si IV 1394 Å line emission,", Monthly Notices of the Royal Astronomical Society, 515, 2022 , 2672--2680, Source
Oguzhan Maraba, Shayon Bhattacharya, Martin Conda-Sheridan, Damien Thompson, " Modelling peptide self-assembly within a partially disordered tau filament,", Nano Express, 3, 2022 , 044004, Source
Oisin Culhane, Mark T. Mitchison, John Goold, " Extractable work in quantum electromechanics,", Physical Review E, 106, 2022 , , Source
Olena Synhaivska, Shayon Bhattacharya, Silvia Campioni, Damien Thompson, Peter Niraj Nirmalraj, " Single-Particle Resolution of Copper-Associated Annular $upalpha$-Synuclein Oligomers Reveals Potential Therapeutic Targets of Neurodegeneration,", ACS Chemical Neuroscience, 13, 2022 , 1410--1421, Source
Paraic M. Keane, Clara Zehe, Fergus E. Poynton, Sandra A. Bright, Sandra Estayalo-Adrian, Stephen J. Devereux, Paul M. Donaldson, Igor V. Sazanovich, Michael Towrie, Stanley W. Botchway, Christine J. Cardin, D. Clive Williams, Thorfinnur Gunnlaugsson, Conor Long, John M. Kelly, Susan J. Quinn, " Time-resolved infra-red studies of photo-excited porphyrins in the presence of nucleic acids and in HeLa tumour cells: insights into binding site and electron transfer dynamics,", Physical Chemistry Chemical Physics, 24, 2022 , 27524--27531, Source
Paul Albert, Eric Arazo, Noel E. OConnor, Kevin McGuinness, " Embedding Contrastive Unsupervised Features to~Cluster In- And Out-of-Distribution Noise in~Corrupted Image Datasets,", Lecture Notes in Computer Science, book, 2022 , 402--419, Source
Paul Albert, Mohamed Saadeldin, Badri Narayanan, Brian Mac Namee, Deirdre Hennessy, Noel E. OtextquotesingleConnor, Kevin McGuinness, " Unsupervised domain adaptation and super resolution on drone images for autonomous dry herbage biomass estimation,", , book, 2022 , , Source
P.S. Kumavat, S. Alimohammadi, S.M. OShaughnessy, " A computational conjugate heat transfer study of a rectangular minichannel undergoing sinusoidal flow pulsations,", International Journal of Thermal Sciences, 182, 2022 , 107790, Source
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