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  • Currently displaying 321 - 340 of 30233 publications
Author(s)
Publication title
Journal Name
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Towards Routine Condensed Phase Simulations with Delta-Learned Coupled Cluster Accuracy: Application to Liquid Water
N O'Neill, BX Shi, WJ Baldwin, WC Witt, G Csányi, JD Gale, A Michaelides, C Schran
Journal of chemical theory and computation
(2025)
21
Corrigendum to "Naphthoquinone-tyrptophan reduces neurotoxic Aβ*56 levels and improves cognition in Alzheimer's disease animal model" Neurobiol Dis. 46(3) (2012):663-72.
RS Attali, D Farfara, I Cooper, A Levin, T Ben-Romano, D Trudler, M Vientrov, R Shaltiel-Karyo, DE Shalev, N Segev-Amzaleg, E Gazit, D Segal, D Frenkel
Neurobiology of disease
(2025)
217
A Cathepsin B‐Triggered CO‐Releasing Molecule with a Non‐Toxic Metal Core for Targeted Tumor Delivery
I Černauskienė, E Izquierdo‐García, S Keller, H Betts, K Cariou, V Marchán, G Gasser, GJL Bernardes
Angewandte Chemie International Edition
(2025)
65
A Cathepsin B‐Triggered CO‐Releasing Molecule with a Non‐Toxic Metal Core for Targeted Tumor Delivery
I Černauskienė, E Izquierdo‐García, S Keller, H Betts, K Cariou, V Marchán, G Gasser, GJL Bernardes
Angewandte Chemie
(2025)
138
Rethinking neurodegeneration through a co-proteinopathy lens
YP Zhang, S Kedia, D Klenerman
Trends Neurosci
(2025)
48
Mapping chromatin structure at base-pair resolution unveils a unified model of cis-regulatory element interactions
H Li, JLT Dalgleish, G Lister, MJ Maristany, J Huertas, AM Dopico-Fernandez, JC Hamley, N Denny, G Bloye, W Zhang, L Hentges, R Doll, Y Wei, M Maresca, E Dimitrova, L Pytowski, EAJ Tunnacliffe, M Kassouf, D Higgs, E de Wit, RJ Klose, L Schermelleh, R Collepardo-Guevara, TA Milne, JOJ Davies
Cell
(2025)
188
Identification of potent high-affinity secondary nucleation inhibitors of Aβ42 aggregation from an ultra-large chemical library using Deep Docking
M Brezinova, ZF Brotzakis, RI Horne, V Roy Chowdhury, RC Gregory, Y Bian, A González Díaz, F Gentile, M Vendruscolo
Mol Syst Biol
(2025)
22
Design Principles for Air Tolerance in Pyridinium‐Based Flow Batteries
ME Carrington, E Jónsson, CP Grey
Advanced Materials
(2025)
38
Modular protein scaffold architecture and AI-guided sequence optimization facilitate de novo metalloenzyme engineering.
P Wagner Egea, F Delhommel, G Mustafa, F Leiss-Maier, L Klimper, T Badmann, A Heider, I Wille, M Groll, M Sattler, C Zeymer
Structure (London, England : 1993)
(2025)
34
Label-free estimation of regulatory T cell activation markers using Raman spectroscopy with machine learning.
A Azari-Pour, A Chamkalani, S Rangan, KN MacDonald, M Huynh, MK Levings, HG Schulze, JM Piret, B Gopaluni
Scientific reports
(2025)
15
Pore network tortuosity controls fast charging in supercapacitors.
T Kress, X Liu, AC Forse
Nature materials
(2025)
25
Thermochromic hydrogel with high transmittance modulation and fast response for flexible smart windows.
F Jiang, K Yu, R Kieffer, D de Jong, RM Parker, S Vignolini, M-E Aubin-Tam
Communications Materials
(2025)
6
PhaseXplorer Creates High-Dimensional Phase Diagrams with Closed-Loop Active Learning
SAH Jansen, LSA Dreyer, J van Basten, Y Yao, DE Otzen, TFA de Greef, TPJ Knowles, EW Meijer, NA Erkamp
ACS nano
(2025)
19
Machine learning-assisted construction of a lignin carbon dots sensor array for detecting food colorants
X Wang, J Huo, H Gu, H Jing, Y Rao, Z Zhao, X Li, Y Liu, H Ma
Food Chem
(2025)
496
Recent advances in the antimicrobial potential of boron cluster compounds
WJ Price Cunliffe, PJ Rutledge, LM Rendina
RSC Med Chem
(2025)
17
Deep learning assessment of nativeness and pairing likelihood for antibody and nanobody design with AbNatiV2
A Ramon, N Frassetto, H Zhao, X Xu, M Greenig, S Onuoha, P Sormanni
(2025)
An electrochemical sensor based on cuprite modified multiwall carbon nanotube paste electrode for the selective detection of iodide in aqueous medium
S Bibi, A Bibi, MI Zaman, A Niaz, A Abbas, MA Ismail, L Daohui, HE Osman
Diamond and Related Materials
(2025)
159
Graphene oxide-based and porous nanocarriers for drug delivery developed with computational and experimental approaches
ÖZ Güner-Yılmaz, B Kocaaga, A Yılmaz, M Balcik, O Kurkcuoglu, FA Sungur, R Yavuz, N Karatepe, M Tatlier, A Sirkecioglu, S Hooshmand, MA Miavaghi, MA Zabara, A Yürüm, MK Bayazıt, S Batirel, FS Güner
Surfaces and Interfaces
(2025)
76
Visualising the Energy Landscape for a Molecular Dynamics Trajectory
V Neuman, P Wesołowski, K Bojarski, D Dewan, M Schäffler, P Smardz, D Wales
(2025)
Neurodegeneration emerges at a cellular tipping point between aggregate accumulation and removal.
MW Cotton, S Venkatesan, JS Beckwith, D Böken, CK Xu, E Fertan, JC Breiter, LE Berkowicz, LS Salazar, A Von Schulze, EA Andrzejewska, EE Brock, HL Han, MM Schneider, DD Sahtoe, D Baker, JB Rowe, A Goriely, WA McEwan, TPJ Knowles, SF Lee, R Halfmann, D Klenerman, G Meisl
(2025)