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Currently displaying 61 - 80 of 27859 publications

Mold: a LAMMPS package to compute interfacial free energies and nucleation rates

AR Tejedor, I Sanchez-Burgos, E Sanz, C Vega, FJ Blas, RL Davidchack, ND Pasquale, J Ramirez, JR Espinosa

– Journal of Open Source Software

(2024)

6083

(doi: 10.21105/joss.06083)

Tertiary Amides as Directing Groups for Enantioselective C-H Amination using Ion-Paired Rhodium Complexes.

KJ Paterson, A Dahiya, BD Williams, RJ Phipps

– Angewandte Chemie International Edition

(2024)

63,

e202317489

(doi: 10.1002/anie.202317489)

Unraveling metastable Markovian open quantum systems

CA Brown, K Macieszczak, RL Jack

– Physical Review A

(2024)

109,

022244

(doi: 10.1103/PhysRevA.109.022244)

Cation ordering in synthetic layered double hydroxides

M Vucelic, W Jones, GD Moggridge

– Clays and Clay Minerals

(2024)

45,

803

(doi: 10.1346/CCMN.1997.0450604)

Continuous flow synthesis enabling reaction discovery

AI Alfano, J García-Lacuna, OM Griffiths, SV Ley, M Baumann

– Chemical science

(2024)

15,

4618

(doi: 10.1039/d3sc06808k)

Partial and complete wetting of droplets of active Brownian particles.

F Turci, RL Jack, NB Wilding

– Soft Matter

(2024)

20,

2060

(doi: 10.1039/d3sm01493b)

A Relationship between the Structures and Neurotoxic Effects of Aβ Oligomers Stabilized by Different Metal Ions.

S Chia, RL Cataldi, FS Ruggeri, R Limbocker, I Condado-Morales, K Pisani, A Possenti, S Linse, TPJ Knowles, J Habchi, B Mannini, M Vendruscolo

– ACS chemical neuroscience

(2024)

15,

1125

(doi: 10.1021/acschemneuro.3c00718)

Palladium (II)-Catalyzed C−H Activation with Bifunctional Ligands: From Curiosity to Industrialization

K Wu, N Lam, DA Strassfeld, Z Fan, JX Qiao, T Liu, D Stamos, J-Q Yu

– Angew Chem Int Ed Engl

(2024)

e202400509

(doi: 10.1002/anie.202400509)

An Upstream G-Quadruplex DNA Structure Can Stimulate Gene Transcription

Y Chen, A Simeone, L Melidis, SM Cuesta, D Tannahill, S Balasubramanian

– ACS chemical biology

(2024)

19,

736

(doi: 10.1021/acschembio.3c00775)

Unlocking Amides: A General Method for the Self-Immolative Release of Amide-Containing Molecules

T Wharton, F Crawshay-Williams, T Schober, RA Floto, DR Spring

– Angewandte Chemie International Edition

(2024)

e202402267

(doi: 10.1002/anie.202402267)

Targeted protein editing with an antibody-based system

M Vendruscolo, O Rimon, J Konc, M Ali, VR Chowdhury, P Sormanni, G Bernardes

(2024)

(doi: 10.21203/rs.3.rs-3947849/v1)

Interchange of Weyl Points in the Phonon Bands of a Half-Metal Alloy

SJ Jenkins, GP Srivastava

– Physical review B (PRB)

(2024)

109,

085140

(doi: 10.1103/PhysRevB.109.085140)

Rapidly convergent coupled-cluster Monte Carlo using a Chebyshev projector

Z Zhao, M-A Filip, AJW Thom

(2024)

(link to publication)

High-Capacity, Cooperative CO2 Capture in a Diamine-Appended Metal-Organic Framework through a Combined Chemisorptive and Physisorptive Mechanism.

Z Zhu, H Tsai, ST Parker, J-H Lee, Y Yabuuchi, HZH Jiang, Y Wang, S Xiong, AC Forse, B Dinakar, A Huang, C Dun, PJ Milner, A Smith, P Guimarães Martins, KR Meihaus, JJ Urban, JA Reimer, JB Neaton, JR Long

– J Am Chem Soc

(2024)

146,

6072

(doi: 10.1021/jacs.3c13381)

Chemistry-albedo feedbacks offset up to a third of forestation's CO2 removal benefits.

J Weber, JA King, NL Abraham, DP Grosvenor, CJ Smith, YM Shin, P Lawrence, S Roe, DJ Beerling, MV Martin

– Science (New York, N.Y.)

(2024)

383,

860

(doi: 10.1126/science.adg6196)