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Currently displaying 41 - 60 of 29383 publications

Accurate and efficient machine learning interatomic potentials for finite temperature modelling of molecular crystals.

F Della Pia, BX Shi, V Kapil, A Zen, D Alfè, A Michaelides

– Chemical Science

(2025)

(doi: 10.1039/d5sc01325a)

SIDS and Sustainable Finance: A Systems Based Risk Approach to Improve Access to Private Investment

N Habib, H Parris

– Island Studies Journal

(2025)

Early access,

(doi: 10.24043/001c.136799)

Ten principles for transforming economics in a time of global crises

JO Kenter, S Martino, SJ Buckton, S Waddock, B Agarwal, A Anger-Kraavi, R Costanza, AP Hejnowicz, P Jones, JO Lafayette, J Kabubo-Mariara, N Mukherjee, KE Pickett, C Riedy, S Waddell

– Nature Sustainability

(2025)

(doi: 10.1038/s41893-025-01562-4)

Machine Learning-Driven Optimization of Continuous-Flow Photoredox Amine Synthesis

P Jorayev, S Soritz, S Sung, MI Jeraal, D Russo, A Barthelme, FC Toussaint, MJ Gaunt, AA Lapkin

– Organic Process Research & Development

(2025)

29,

1411

(doi: 10.1021/acs.oprd.4c00533)

Yielding in colloidal gels: From local structure to mesoscale strand breakage and macroscopic failure

H Bhaumik, TB Liverpool, CP Royall, RL Jack

– Physical Review E

(2025)

111,

055412

(doi: 10.1103/physreve.111.055412)

Spin-Symmetry Projected Constrained Unrestricted Hartree-Fock

A Ayati, HGA Burton, S De Baerdemacker

– Journal of Chemical Theory and Computation

(2025)

21,

5409

(doi: 10.1021/acs.jctc.5c00068)

One-carbon homologation of alkenes.

MC Grocott, MJ Gaunt

– Nature

(2025)

643,

130

(doi: 10.1038/s41586-025-09159-9)

Chemistry–climate feedback of atmospheric methane in a methane-emission-flux-driven chemistry–climate model

L Stecher, F Winterstein, P Jöckel, M Ponater, M Mertens, M Dameris

– Atmospheric Chemistry and Physics

(2025)

25,

5133

(doi: 10.5194/acp-25-5133-2025)

Nanoconfined superionic water is a molecular superionic

SW Coles, A Hajibabaei, V Kapil, XR Advincula, C Schran, SJ Cox, A Michaelides

(2025)

(link to publication)

Fluoride Enhances Alcohol Binding Within a Trigonal‐Prismatic Metal‐Organic Capsule

Y Yang, TK Ronson, D Hou, KH Luo, JR Nitschke

– Angewandte Chemie

(2025)

e202505137

(doi: 10.1002/ange.202505137)

Unexpected structural isomers of AlFe2O4+ and AlCo2O4+: vibrational spectroscopy and ion mobility combined with quantum chemistry

W Schwedland, TC Penna, H Windeck, F Müller, S Leach, J Sauer, XR Advincula, F Berger, N Ishida, K Ohshimo, F Misaizu, YK Li, A Chakraborty, F Horn, KR Asmis

– Chemical science

(2025)

(doi: 10.1039/d5sc02681d)

Bioelectricity generation bySymbiodinium microadriaticum: a symbiont-forming photosynthetic dinoflagellate alga from coral reefs

L Marcel, JT Simon, JM Lawrence, S Menkin, AC Barbrook, RER Nisbet, CJ Howe, JZ Zhang

(2025)

(doi: 10.1101/2025.05.16.654495)

Using a stable protein scaffold to display peptides that bind to alpha-synuclein fibrils

S Bismut, MM Schneider, M Miyasaki, Y Feng, EJ Wilde, MD Gunawardena, TPJ Knowles, GS Kaminski Schierle, LS Itzhaki, JR Kumita

– Protein Science

(2025)

34,

e70150

(doi: 10.1002/pro.70150)

Using a stable protein scaffold to display peptides that bind to alpha‐synuclein fibrils

S Bismut, MM Schneider, M Miyasaki, Y Feng, EJ Wilde, MD Gunawardena, TPJ Knowles, GS Kaminski Schierle, LS Itzhaki, JR Kumita

– Protein Science

(2025)

34,

e70150

(doi: 10.1002/pro.70150)

Surface oxygen drives electrolyte degradation at Ni-rich battery cathodes

I Stephens, D Thornton, I Seymour, Z Shen, W Dose, A Aguadero, C Grey, MFL De Volder, M Ryan, B Davies

(2025)

(doi: 10.21203/rs.3.rs-6512009/v1)

Multi-Omics Analysis for Assessment of Hepatoprotective Activity of Nature-derived Polyphenols in Case of Non-Alcoholic Fatty Liver Disease (NAFLD) Mouse Model

AG Brzhozovskiy, SD Semenov, NV Zakharova, MN Yurova, AY Zherebker, AE Bugrova, OA Kovaleva, AL Semenov, DP Abroskin, DA Kharina, EI Fedoros, AS Kononikhin, EN Nikolaev

(2025)

(doi: 10.20944/preprints202505.1120.v1)

A cellulose-based CO2 capture foam-like porous material for biological carbon fixation

D Zhou, H Zhang, Y Rao, X Li, H Zhang, Y Liu, H Ma

– Chemical Engineering Journal

(2025)

512,

162660

(doi: 10.1016/j.cej.2025.162660)