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Currently displaying 1261 - 1280 of 30204 publications

Crumbling crystals: on the dissolution mechanism of NaCl in water

N O'Neill, C Schran, SJ Cox, A Michaelides

Physical chemistry chemical physics : PCCP

(2024)

26933

(doi: 10.1039/d4cp03115f)

Capturing single-molecule properties does not ensure accurate prediction of biomolecular phase diagrams

A Feito, I Sanchez-Burgos, A Rey, R Collepardo-Guevara, JR Espinosa, AR Tejedor

(2024)

(doi: 10.1101/2024.10.24.619983)

Identification and characterization of thiamine analogs with antiplasmodial activity.

I Fathoni, TCS Ho, AHY Chan, FJ Leeper, K Matuschewski, KJ Saliba

Antimicrob Agents Chemother

(2024)

e0109624

(doi: 10.1128/aac.01096-24)

Distributed direct air capture of carbon dioxide by synergistic water harvesting

G Li, Y Wang, L Qu, H Ding, P Webley

(2024)

(doi: 10.21203/rs.3.rs-3578965/v1)

Bis‐Squaramide‐Based [2]Rotaxane Hosts for Anion Recognition

A Arun, A Docker, PD Beer

Chemistry - A European Journal

(2024)

e202402731

(doi: 10.1002/chem.202402731)

Osmolyte-induced protein stability changes explained by graph theory

M Miotto, N Warner, G Ruocco, GG Tartaglia, OA Scherman, E Milanetti

Computational and structural biotechnology journal

(2024)

4077

(doi: 10.1016/j.csbj.2024.10.014)

Fundamental performance bounds on time-series generation using reservoir computing

D Qian, I Fiete

(2024)

Immobilising and Interfacing Poly(Heptazine Imide) Ionic Carbon Nitride for Photo(electro)catalytic Fuel and Chemical Production

C Pulignani

(2024)

(doi: 10.17863/CAM.117387)

An introduction to Topology in soft and biological matter

L Tubiana, A Rosa, S Jackson, S Čopar, E Locatelli, D Michieletto, MD Stefano

(2024)

(doi: 10.52843/cassyni.03y5r9)

Datatractor: Metadata, automation, and registries for extractor interoperability in the chemical and materials sciences

ML Evans, G-M Rignanese, D Elbert, P Kraus

(2024)

Metallo‐Supramolecular Helicates as Surface‐Enhanced Raman Scattering (SERS) Substrates with High Tailorability

B Song, Z Zhang, W Dou, X Zhao, Y Niu, C Wang, C Li, JR Nitschke, Y Tian, H Yang, L Xu

Angewandte Chemie

(2024)

137

e202414089

(doi: 10.1002/ange.202414089)

Metallo‐Supramolecular Helicates as Surface‐Enhanced Raman Scattering (SERS) Substrates with High Tailorability

B Song, Z Zhang, W Dou, X Zhao, Y Niu, C Wang, C Li, JR Nitschke, Y Tian, H-B Yang, L Xu

Angew Chem Int Ed Engl

(2024)

e202414089

(doi: 10.1002/anie.202414089)

Graph neural processes for molecules: an evaluation on docking scores and strategies to improve generalization

M García-Ortegón, S Seal, C Rasmussen, A Bender, S Bacallado

Journal of cheminformatics

(2024)

115

(doi: 10.1186/s13321-024-00904-2)

Direct Detection of Key Intermediates during the Product Release in Rhenium Bipyridine-Catalyzed CO2 Reduction Reaction

S Chattopadhyay, MH Cheah, R Lomoth, L Hammarström

ACS Catalysis

(2024)

16324

(doi: 10.1021/acscatal.4c06044)

Characterisation of rouaite, an unusual copper-containing pigment in early modern English wall paintings, by synchrotron micro X-Ray diffraction and micro X-Ray absorption spectroscopy

EH Purdy, S Critchley, C Holé, M Cotte, A Kirkham, M Casford

Applied Physics A

(2024)

130

817

(doi: 10.1007/s00339-024-07954-1)