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Yusuf Hamied Department of Chemistry

 

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  • Currently displaying 721 - 740 of 29331 publications
Going for Gold(-Standard): Attaining Coupled Cluster Accuracy in Oxide-Supported Nanoclusters
BX Shi, DJ Wales, A Michaelides, CW Myung
– J Chem Theory Comput
(2024)
20,
5306
(doi: 10.1021/acs.jctc.4c00379)
Biomolecular condensates with complex architectures via controlled nucleation
NA Erkamp, MAM Verwiel, D Qian, T Sneideris, FA Spaepen, DA Weitz, JCM van Hest, TPJ Knowles
– Nature Chemical Engineering
(2024)
1,
430
(doi: 10.1038/s44286-024-00077-7)
Identification of high-affinity secondary nucleation inhibitors of Aβ42 aggregation from an ultra-large chemical library using Deep Docking
M Vendruscolo, M Brezinova, F Brotzakis, R Horne, VR Chowdhury, R Gregory, F Gentile
(2024)
(doi: 10.21203/rs.3.rs-4512167/v1)
Harnessing Maxwell’s demon to establish a macroscale concentration gradient
J Pruchyathamkorn, B-NT Nguyen, AB Grommet, M Novoveska, TK Ronson, JD Thoburn, JR Nitschke
– Nat Chem
(2024)
16,
1558
(doi: 10.1038/s41557-024-01549-2)
Calibrated prediction of scarce adverse drug reaction labels with conditional neural processes
M Garcia-Ortegon, S Seal, S Singh, A Bender, S Bacallado
(2024)
(doi: 10.1101/2024.06.07.598036)
Improved Detection of Drug-Induced Liver Injury by Integrating Predicted in vivo and in vitro Data.
S Seal, DP Williams, L Hosseini-Gerami, M Mahale, AE Carpenter, O Spjuth, A Bender
(2024)
(doi: 10.1101/2024.01.10.575128)
Fourfold increase in photocurrent generation of Synechocystis sp. PCC 6803 by exopolysaccharide deprivation
LT Wey, EI Wroe, V Sadilek, L Shang, X Chen, JZ Zhang, CJ Howe
– Electrochimica Acta
(2024)
497,
144555
(doi: 10.1016/j.electacta.2024.144555)
Excited State-Specific CASSCF Theory for the Torsion of Ethylene.
S Saade, HGA Burton
– Journal of Chemical Theory and Computation
(2024)
20,
5105
(doi: 10.1021/acs.jctc.4c00212)
Global agricultural N2O emission reduction strategies deliver climate benefits with minimal impact on stratospheric O3 recovery
J Weber, J Keeble, NL Abraham, DJ Beerling, MV Martin
– npj Climate and Atmospheric Science
(2024)
7,
121
(doi: 10.1038/s41612-024-00678-2)
Fragment-Based Discovery of Novel MUS81 Inhibitors
GW Collie, U Börjesson, Y Chen, Z Dong, P Di Fruscia, A Gohlke, A Hoyle, TA Hunt, MH Jesani, H Luo, J Luptak, AG Milbradt, P Narasimhan, M Packer, S Patel, J Qiao, RI Storer, CJ Stubbs, J Tart, C Truman, AT Wang, MG Wheeler, J Winter-Holt
– ACS medicinal chemistry letters
(2024)
15,
1151
(doi: 10.1021/acsmedchemlett.3c00453)
Condensed Matter Systems Exposed to Radiation: Multiscale Theory, Simulations, and Experiment.
AV Solov'yov, AV Verkhovtsev, NJ Mason, RA Amos, I Bald, G Baldacchino, B Dromey, M Falk, J Fedor, L Gerhards, M Hausmann, G Hildenbrand, M Hrabovský, S Kadlec, J Kočišek, F Lépine, S Ming, A Nisbet, K Ricketts, L Sala, T Schlathölter, AEH Wheatley, IA Solov'yov
– Chem Rev
(2024)
124,
8014
(doi: 10.1021/acs.chemrev.3c00902)
Thermodynamically consistent flocking: from discontinuous to continuous transitions
T Agranov, RL Jack, ME Cates, É Fodor
– New Journal of Physics
(2024)
26,
063006
(doi: 10.1088/1367-2630/ad4dd6)
Capturing carbon dioxide from air with charged-sorbents
H Li, ME Zick, T Trisukhon, M Signorile, X Liu, H Eastmond, S Sharma, TL Spreng, J Taylor, JW Gittins, C Farrow, SA Lim, V Crocellà, PJ Milner, AC Forse
– Nature
(2024)
630,
654
(doi: 10.1038/s41586-024-07449-2)
Quasi-Solid-State Electrolyte Induced by Metallic MoS2 for Lithium–Sulfur Batteries
Z Li, ZJ Yang, J Moloney, CP Yu, M Chhowalla
– ACS nano
(2024)
18,
16041
(doi: 10.1021/acsnano.4c05002)
Stimulating Creativity Through Cognitive Symmetry Breaking: Tagorean Theory of Sustainable Human Development
S Ghosh
(2024)
(doi: 10.35542/osf.io/pcxhb)
Raman Spectroscopy Measurements Support Disorder-driven Capacitance in Nanoporous Carbons
X Liu, J Choi, Z Xu, C Grey, S Fleischmann, A Forse
(2024)
(doi: 10.26434/chemrxiv-2024-kwnrh)
Energy Landscapes and Structural Ensembles of Glucagon-like Peptide-1 Monomers.
AD Keith, EP Brichtová, JG Barber, DJ Wales, SE Jackson, K Röder
– The journal of physical chemistry. B
(2024)
128,
5601
(doi: 10.1021/acs.jpcb.4c01794)
Energy landscapes for the quantum approximate optimization algorithm
C Boy, D Wales
– Physical Review A
(2024)
109,
062602
(doi: 10.1103/physreva.109.062602)
Nanomedicine Targeting Cuproplasia in Cancer: Labile Copper Sequestration Using Polydopamine Particles Blocks Tumor Growth In Vivo through Altering Metabolism and Redox Homeostasis.
J Bonet-Aleta, M Encinas-Gimenez, M Oi, AT Pezacki, V Sebastian, A de Martino, A Martín-Pardillos, P Martin-Duque, JL Hueso, CJ Chang, J Santamaria
– ACS Applied Materials and Interfaces
(2024)
16,
29844
(doi: 10.1021/acsami.4c04336)
Co-aggregation with Apolipoprotein E modulates the function of Amyloid-β in Alzheimer’s disease
Z Xia, EE Prescott, A Urbanek, HE Wareing, MC King, A Olerinyova, H Dakin, T Leah, KA Barnes, MM Matuszyk, E Dimou, E Hidari, YP Zhang, JYL Lam, JSH Danial, MR Strickland, H Jiang, P Thornton, DC Crowther, S Ohtonen, M Gómez-Budia, SM Bell, L Ferraiuolo, H Mortiboys, A Higginbottom, SB Wharton, DM Holtzman, T Malm, RT Ranasinghe, D Klenerman, S De
– Nature communications
(2024)
15,
4695
(doi: 10.1038/s41467-024-49028-z)

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