Results 201 to 210 of about 38,633 (256)

Resolving Nanoscale Heterogeneities in Lead Halide Perovskites Through Low‐Dose Concurrent 4D‐STEM‐EDX Mapping

Advanced Materials, EarlyView.
Mixed‐cation lead mixed‐halide perovskites suffer from structural instabilities linked to nanoscale heterogeneity. To probe this non‐destructively, a low‐dose, concurrent 4D‐STEM and EDX methodology has been developed. Examining a (FA0.83Cs0.17)Pb(I0.8Br0.2)3 film revealed a complex mosaic of coexisting crystal structures. Crucially, local deficiencies
Jinseok Ryu, Alexandra A. Sheader, Mohsen Danaie, David G. Hopkinson, Katherine E. MacArthur, Nakita K. Noel, Christopher S. Allen   +6 more
wiley   +1 more source

In-silico prediction of multi‑target mechanisms of Pinellia ternata phytochemicals in lung cancer: Evidence from a graph‑attention‑guided virtual screening and multi‑scale simulations. [PDF]

PLoS One
Bian G, Zhang Y, Shen Y, Xiao P, Zhang D, Xie J, Li X, Chen D, Hu K, Hu C.   +9 more
europepmc   +1 more source

Sustainable Poly(Lactic Acid)/Graphene Oxide Bioelectronic Platform for Neurotransmitters Sensing and Tunable Stimulation of Astrocytes

Advanced Materials, EarlyView.
This work introduces sustainable PLA/graphene oxide bioelectronic interfaces featuring electrodes with tunable conductivity and strong electrocatalytic performance. These platforms were used to implement a new method for tuning astrocyte Ca2+ signaling and for the efficient detection of key biomarkers.
Alessandra Scidà, Giulia Cazzador, Roberta Fabbri, Matteo Calosi, Alessandro Silvestri, Andrea Candini, Fabiola Liscio, Franco Corticelli, Aikaterini Konstantoulaki, Andrea D'Iorio, Marco Caprini, Vincenzo Palermo, Monica Bertoldo, Valentina Benfenati, Chiara Zanardi, Emanuele Treossi   +15 more
wiley   +1 more source

2D-JCOG: Transforming 1D ¹H NMR Spectra into J-δ Correlation Maps via the Shared Splitting Theorem and Graph Neural Networks. [PDF]

Anal Chem
Cobas C.
europepmc   +1 more source

Closed‐Loop Solid‐State Synthesis Planning for Materials Discovery With Large Language Models

Advanced Materials, EarlyView.
Leveraging literature data, we build a large‐language‐model‐driven workflow that extracts synthesis steps from 4407 papers, retrieves similar precedents, and generates candidate solid‐state synthesis recipes. The system benchmarks against ground‐truth and then operates in a closed loop with experiments to synthesize oxy‐selenide electrolyte materials ...
Dong Won Jeon, Dong Hwi Kim, Taeyang Jeon, Joo Yeong Na, Heegyu Kim, Hyunsouk Cho, Dae Soo Jung, Ju Li, Jin‐Sung Park, Sung Beom Cho   +9 more
wiley   +1 more source

Decoupling Size from Shape: Cellular Sheaf Laplacians as Ligand Geometry Descriptors for Binding Affinity Prediction. [PDF]

Int J Mol Sci
Akgüller Ö, Balcı MA, Cioca G.
europepmc   +1 more source

Comparative entropy analysis of 2D transition metal tetrahydroxyquinones via machine learning approaches. [PDF]

Sci Rep
Irfan M, Bashir N, Gaid ASA, Althobaiti T, Rehman HU, Semaničová-Feňovčíková A.   +5 more
europepmc   +1 more source

Property prediction of energetic materials based on directional-aware graph attention network. [PDF]

Sci Prog
Li S, Zhao X, Yang J, Li S.
europepmc   +1 more source

Editorial: Advanced functional materials, structures, and devices for advancing human healthcare applications. [PDF]

Front Chem
Li F, Li T, Hao Z, Jing D.
europepmc   +1 more source

A conformational benchmark for optical property prediction with solvent-aware graph neural networks. [PDF]

Commun Chem
Potapov D, Rogovoi S, Khrabrov K, Ushenin K, Korovin A, Ber A, Kadurin A, Tsypin A.   +7 more
europepmc   +1 more source