Yusuf Hamied Department of Chemistry

Publications

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  • Currently displaying 1901 - 1920 of 31569 publications
Author(s)
Publication title
Journal Name
Publication year
Tensor Train Optimization for Conformational Sampling of Organic Molecules
C Zurek, RA Mallaev, A Paul, N van Staalduinen, P Pracht, R Ellerbrock, C Bannwarth
(2024)
(doi: 10.26434/chemrxiv-2024-jjns1)
Crash Testing Machine Learning Force Fields for Molecules, Materials, and Interfaces: Model Analysis in the TEA Challenge 2023
I Poltavsky, A Charkin-Gorbulin, M Puleva, G Cordeiro Fonseca, I Batatia, NJ Browning, S Chmiela, M Cui, JT Frank, S Heinen, B Huang, S Käser, A Kabylda, D Khan, C Müller, AJA Price, K Riedmiller, K Töpfer, T Wai Ko, M Meuwly, M Rupp, G Csanyi, OA von Lilienfeld, JT Margraf, K-R Müller, A Tkatchenko
(2024)
(doi: 10.26434/chemrxiv-2024-ctdm3)
A rapid in vivo pipeline to identify small molecule inhibitors of amyloid aggregation.
M Kamal, J Knox, RI Horne, OS Tiwari, AR Burns, D Han, D Levy, D Laor Bar-Yosef, E Gazit, M Vendruscolo, PJ Roy
Nat Commun
(2024)
15
(doi: 10.1038/s41467-024-52480-6)
Insulating behaviour in room temperature rhombohedral LiNiO2 cathodes is driven by dynamic correlation
H Banerjee, M Aichhorn, CP Grey, AJ Morris
Journal of Physics: Energy
(2024)
6
(doi: 10.1088/2515-7655/ad7980)
Protein language models are performant in structure-free virtual screening.
HYI Lam, JS Guan, XE Ong, R Pincket, Y Mu
Briefings in Bioinformatics
(2024)
25
(doi: 10.1093/bib/bbae480)
Concurrent oxygen evolution reaction pathways revealed by high-speed compressive Raman imaging.
R Pandya, F Dorchies, D Romanin, J-F Lemineur, F Kanoufi, S Gigan, AW Chin, HB de Aguiar, A Grimaud
Nature communications
(2024)
15
(doi: 10.1038/s41467-024-52536-7)
Crash Testing Machine Learning Force Fields for Molecules, Materials, and Interfaces: Molecular Dynamics in the TEA Challenge 2023
I Poltavsky, M Puleva, A Charkin-Gorbulin, G Cordeiro Fonseca, I Batatia, NJ Browning, S Chmiela, M Cui, JT Frank, S Heinen, B Huang, S Käser, A Kabylda, D Khan, C Müller, AJA Price, K Riedmiller, K Töpfer, T Wai Ko, M Meuwly, M Rupp, G Csanyi, OA von Lilienfeld, JT Margraf, K-R Müller, A Tkatchenko
(2024)
(doi: 10.26434/chemrxiv-2024-jhm5l)
Nuclear Wavefunctions of Dispersion Bound Systems: Endohedral Eigenstates of Endofullerenes
K Panchagnula
(2024)
(doi: 10.17863/CAM.115396)
Collective dynamics in lattice models far from equilibrium
L Yao
(2024)
(doi: 10.17863/CAM.114221)
Displacive Jahn--Teller transition in NaNiO$_2$
LAV Nagle-Cocco, AR Genreith-Schriever, JMA Steele, C Tacconis, JD Bocarsly, O Mathon, JC Neuefeind, J Liu, CA O'Keefe, AL Goodwin, CP Grey, JSO Evans, SE Dutton
(2024)
(doi: 10.48550/arxiv.2408.01267)
Conductive and Stimuli-Responsive Supramolecular Polymer Networks for Biomedical Applications
S O'Neill
(2024)
Conductive and Stimuli-Responsive Supramolecular Polymer Networks for Biomedical Applications
S O'Neill
(2024)
Score-Based Generative Models for Designing Binding Peptide Backbones
JD Boom, M Greenig, P Sormanni, P Liò
(2024)
(doi: 10.48550/arxiv.2310.07051)
Conductive and Stimuli-Responsive Supramolecular Polymer Networks for Biomedical Applications
S O'Neill
(2024)
(doi: 10.17863/CAM.115746)
Structural Origins and Functions of Colour Diversity in Sea Slugs: Novel Photonic Architectures, Biological Roles, and Biomimetic Applications
S Humphrey
(2024)
(doi: 10.17863/CAM.115821)
Fiber lithium-ion battery from a view of application.
X Cheng, C Lu, J Li, C Li, H Jiang, Y Zhang, T Song, J Wang, X Gong, B Wang, H Peng
Science Bulletin
(2024)
69
(doi: 10.1016/j.scib.2024.09.037)
Uncovering the Potential of Utilising Terrestrial Biogenic Markers in Ice Cores as Proxies to Past Environmental Conditions
E Bushrod
(2024)
(doi: 10.17863/CAM.115675)
Single-Payload Bioconjugation to Native Antibodies And A General Method for the Self-Immolative Release of Amide-Containing Molecules
T Wharton
(2024)
(doi: 10.17863/CAM.114785)
Vehicle emission models alone are not sufficient to understand full impact of change in traffic signal timings
AK Schroeder, H Woodward, CMA Le Cornec, T Proust, PJ Benie, S Fan, E Aristodemou, RL Jones, PF Linden, A de Nazelle, AM Boies, MEJ Stettler
Atmospheric Environment X
(2024)
24
(doi: 10.1016/j.aeaoa.2024.100293)
Polarisation effects on the H-bond acceptor properties of sulfonamides
FE Hanna, CA Hunter
Chemical Communications
(2024)
60
(doi: 10.1039/d4cc03530e)
Yusuf Hamied Department of Chemistry
Lensfield Road
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CB2 1EW
T: +44 (0) 1223 336300
enquiries@ch.cam.ac.uk
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