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  • Currently displaying 61 - 80 of 31108 publications
Author(s)
Publication title
Journal Name
Publication year
Quantum Enhancement of Microcanonical Negative HeatCapacity Features in the Melting of Water Clusters
J Hernández-Rojas, F Calvo, DJ Wales
The Journal of Physical Chemistry Letters
(2026)
17
Fast and Accurate Foundation Models for Equivariant Machine-Learned Interatomic Potentials
SR Kavanagh, CW Tan, M Wang, ML Descoteaux, GDM Nascimento, U Unneberg, L Zichi, F Libbi, N Rivano, A Glover, V Bharadwaj, A Johansson, WC Witt, A Musaelian, B Kozinsky
(2026)
StereoselectiveEpimerization of 1,3-Diols Using aChiral Hydrogen Atom Abstraction Catalyst
M Lemmerer, DC Emmet, ASK Lahdenperä, DJ Davies, A Dahiya, K Ermanis, RJ Phipps
Journal of the American Chemical Society
(2026)
148
Finding REMO: a sequencing method for recognition-encoded melamine oligomers.
B Iddon, PH Grab, JT Smith, ON Evans, A-L Cotîrlan, CA Hunter
Chemical science
(2026)
Avalanche-like intercalation and intraparticle correlations in graphite
J Han, GS Phillips, AJ Merryweather, J Lim, C Schnedermann, RL Jack, CP Grey, A Rao
Nature
(2026)
656
Aerosol oxidative potential and reactive species predicted with a chemical kinetics model (KM-OP)
A Mishra, S Lelieveld, M Krüger, SJ Campbell, D Srivastava, GM Lanzafame, S Tomaz, O Favez, N Bonnaire, F Lucarelli, LY Alleman, G Uzu, J-L Jaffrezo, GI Chen, DC Green, M Priestman, AH Tremper, A Barth, M Kalberer, BAM Bandowe, G Lammel, U Pöschl, P Shahpoury, A Albinet, T Berkemeier
Atmospheric Chemistry and Physics
(2026)
26
Selective Inhibitionof CK2: Emerging Strategies andFuture Directions
AR Sokhal, S Krajcovicova, J Iegre, P Brear, C De Fusco, PA Glossop, D Cawkill, M Hyvönen, DR Spring
Journal of medicinal chemistry
(2026)
69
NMR spectroscopic investigation of LiNO3-induced SEI modification in Li–S batteries: a concentration-dependent study
JB Fritzke, M Stockham, M Juramy, SDS Fitch, L Furness, N Garcia-Araez, CP Grey
Faraday discussions
(2026)
Nonequilibrium pathways between cluster morphologies in active phase separation: Necking, rupture, and cavitation
L Yao, ME Cates, RL Jack
Phys Rev E
(2026)
114
Deciphering the infrared spectrum of the hydrated proton using full-dimensional quantum dynamics.
D Mendive-Tapia, C Schran, B Das, F Gatti, M Schröder, D Marx, O Vendrell
Nature chemistry
(2026)
A Plasmon-Enhanced Self-Validating Optoelectronic Nanopore for Ultrasensitive and Robust Hydrogen Sulfide Real-Time Monitoring in Single Living Cells
Z-H Li, D Zhang, L-D Chen, Z Li, S-H Cao, S Cai, G Zheng, W-P Cai, Y-Q Li
Analytical chemistry
(2026)
98
Evaluating electrochemical impedance spectroscopy for SEI characterization in lithium- and sodium-metal batteries
MA Zabara, J Lee, S Menkin, CP Grey
Faraday Discussions
(2026)
Structure–Activity Relationship Study of Protoberberine Alkaloids Reveals Molecular Planarity as a Key Determinant of Membrane Interaction and Protection from Misfolded Protein Oligomers
S Errico, A Bigi, G Fani, M Ambrosino, E Galmiche, F Bemporad, M Vendruscolo, B Mannini, F Chiti
Journal of medicinal chemistry
(2026)
69
Nanoscopic tau aggregates in Parkinson’s disease
F Layburn, D Böken, YP Zhang, K Halliday, D Rodgers, S Kedia, G Nolan, L Kahanawita, B Patel, A Quaegebeur, CH Williams-Gray, D Klenerman
npj Parkinson's Disease
(2026)
Surface-stabilized sub-micron condensates for compartmentalizing synthetic cells and enhanced enzyme kinetics
U Ghosh, E van der Velde, Z Hussain, DWT Brake, C Chen, C Zheng, J van der Gucht, R de Vries, S Deshpande
(2026)
Structure–Property Relationships to Guide the Selection of Fluorinated Ethers for Li–S Batteries
M Stockham, NF Xavier, JB Fritzke, SDS Fitch, L Furness, VK Bharti, N Zhelev, Q Cai, CP Grey, N Garcia-Araez
J Am Chem Soc
(2026)
148
Heteroleptic Triangular Prisms from a Quadrilateral Subcomponent with Continuously Variable Geometry
H Xu, PCP Teeuwen, TK Ronson, JR Nitschke
(2026)
A unified machine-learning framework for ab initio multiscale modeling of liquids
AT Bui, SJ Cox
Proceedings of the National Academy of Sciences
(2026)
123
Heteroleptic Triangular Prisms from a Quadrilateral Subcomponent with Continuously Variable Geometry
H Xu, PCP Teeuwen, TK Ronson, JR Nitschke
(2026)
Long-range machine learning of electron density for twisted bilayer moiré materials
Anonymous
PRX Intelligence
(2026)
1