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Yusuf Hamied Department of Chemistry

 

Publications

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  • Currently displaying 1441 - 1460 of 29490 publications
Platinum-based nanodendrites as glucose oxidase-mimicking surrogates.
JI Garcia-Peiro, J Bonet-Aleta, ML Tamayo-Fraile, JL Hueso, J Santamaria
– Nanoscale
(2023)
15,
14399
(doi: 10.1039/d3nr02026f)
Ganglioside Lipids Inhibit the Aggregation of the Alzheimer’s Related Peptide Amyloid-β
Z Toprakcioglu, A Jayaram, T Knowles
(2023)
(doi: 10.1101/2023.09.10.556751)
Accurate Calculation of Many-Body Energies in Water Clusters Using a Classical Geometry-Dependent Induction Model.
KM Herman, AJ Stone, SS Xantheas
– Journal of chemical theory and computation
(2023)
19,
6805
(doi: 10.1021/acs.jctc.3c00575)
The Implications of Particle Morphology on the Capacity Retention, Side Reactions, and Impedance Build-Up of Nickel-Rich NCMs upon Cycling in Full-Cells: Poly- vs. Single-Crystalline NCM851005
S Oswald, M Bock, HA Gasteiger
– Journal of the Electrochemical Society
(2023)
170,
090505
(doi: 10.1149/1945-7111/acf3a1)
Energy landscapes for proteins described by the UNRES coarse-grained potential
PA Wesołowski, AK Sieradzan, MJ Winnicki, JWR Morgan, DJ Wales
– Biophysical Chemistry
(2023)
303,
107107
(doi: 10.1016/j.bpc.2023.107107)
Global analysis of energy landscapes for materials modeling: A test case for C60
G Csányi, JWR Morgan, DJ Wales
– The Journal of Chemical Physics
(2023)
159,
104107
(doi: 10.1063/5.0167857)
Catalytic degradation of benzene at room temperature over FeN4O2 sites embedded in porous carbon.
H Ding, L Xue, J Cui, Y Wang, D Zhao, X Zhi, R Liu, J Fu, S Liu, B Fu, J Shi, X Xu, GK Li
– Journal of hazardous materials
(2023)
460,
132520
(doi: 10.1016/j.jhazmat.2023.132520)
ACEpotentials.jl: A Julia Implementation of the Atomic Cluster Expansion
WC Witt, CVD Oord, E Gelžinytė, T Järvinen, A Ross, JP Darby, CH Ho, WJ Baldwin, M Sachs, J Kermode, N Bernstein, G Csányi, C Ortner
(2023)
(doi: 10.48550/arxiv.2309.03161)
(link to publication)
Fully First-Principles Surface Spectroscopy with Machine Learning
Y Litman, J Lan, Y Nagata, DM Wilkins
– The journal of physical chemistry letters
(2023)
14,
8175
(doi: 10.1021/acs.jpclett.3c01989)
Chemoenzymatic Photoreforming: A Sustainable Approach for Solar Fuel Generation from Plastic Feedstocks
S Bhattacharjee, C Guo, E Lam, JM Holstein, M Rangel Pereira, CM Pichler, C Pornrungroj, M Rahaman, T Uekert, F Hollfelder, E Reisner
– J Am Chem Soc
(2023)
145,
20355
(doi: 10.1021/jacs.3c05486)
Accurate and efficient structure factors in ultrasoft pseudopotential and projector augmented wave DFT
BX Shi, RJ Nicholls, JR Yates
– Physical Review B
(2023)
108,
115112
(doi: 10.1103/PhysRevB.108.115112)
Energy landscapes and heat capacity signatures for peptides correlate with phase separation propensity
Nicy, R Collepardo-Guevara, JA Joseph, DJ Wales
– QRB Discovery
(2023)
4,
e7
(doi: 10.1017/qrd.2023.5)
A Supramolecular Naphthalene Diimide Radical Anion with Efficient NIR-II Photothermal Conversion for E. coli-Responsive Photothermal Therapy.
H Hu, Y-Y Zhang, H Ma, Y Yang, S Mei, J Li, J-F Xu, X Zhang
– Angewandte Chemie (International ed. in English)
(2023)
62,
e202308513
(doi: 10.1002/anie.202308513)
Sodium Tetrakis(hexafluoroisopropyloxy)aluminates: Synthesis and Electrochemical Characterisation of a Room-Temperature Solvated Ionic Liquid
DMC Ould, S Menkin, HE Smith, V Riesgo-González, TH Smith, MNB Chinn, E Jónsson, AD Bond, CP Grey, DS Wright
– Chemelectrochem
(2023)
11,
e202300381
(doi: 10.1002/celc.202300381)
Author Correction: Sensing the DNA-mismatch tolerance of catalytically inactive Cas9 via barcoded DNA nanostructures in solid-state nanopores
SE Sandler, NE Weckman, S Yorke, A Das, K Chen, R Gutierrez, UF Keyser
– Nature Biomedical Engineering
(2023)
8,
335
(doi: 10.1038/s41551-023-01099-x)
Effects of Processing-Induced Contamination on Organic Electronic Devices
D Simatos, IE Jacobs, I Dobryden, M Nguyen, A Savva, D Venkateshvaran, M Nikolka, J Charmet, LJ Spalek, M Gicevičius, Y Zhang, G Schweicher, DJ Howe, S Ursel, J Armitage, IB Dimov, U Kraft, W Zhang, M Alsufyani, I McCulloch, RM Owens, PM Claesson, TPJ Knowles, H Sirringhaus
– Small methods
(2023)
7,
e2300476
(doi: 10.1002/smtd.202300476)
Of hopeful narratives and historical injustices - An analysis of just transition narratives in European coal regions
L Hermwille, M Schulze-Steinen, V Brandemann, M Roelfes, Z Vrontisi, E Kesküla, A Anger-Kraavi, Ł Trembaczowski, W Mandrysz, R Muster, A Zygmunt-Ziemianek
– Energy Research & Social Science
(2023)
104,
103263
(doi: 10.1016/j.erss.2023.103263)
Artificial intelligence (AI) methodology in structural biology
A Bender, C de Graaf, NM O'Boyle
– Current Opinion in Structural Biology
(2023)
82,
102676
(doi: 10.1016/j.sbi.2023.102676)
Vitamin B12 bioaccumulation in Chlorella vulgaris grown on food waste-derived anaerobic digestate
KP Papadopoulos, MF de Souza, L Archer, ACZ Illanes, EL Harrison, F Taylor, MP Davey, DA Gallardo, AJ Komakech, S Radmehr, A Holzer, E Meers, AG Smith, P Mehrshahi
– Algal Research
(2023)
75,
103290
(doi: 10.1016/j.algal.2023.103290)
wfl Python toolkit for creating machine learning interatomic potentials and related atomistic simulation workflows
E Gelžinytė, S Wengert, TK Stenczel, HH Heenen, K Reuter, G Csányi, N Bernstein
– The Journal of chemical physics
(2023)
159,
124801
(doi: 10.1063/5.0156845)

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