Results 211 to 220 of about 55,177 (267)

Interfacial Degradation Electrochemistry of Micro‐Silicon Anodes in Solid‐State and Liquid Electrolytes

Advanced Science, EarlyView.
This schematic compares m‐Si degradation in liquid electrolyte and solid electrolyte systems. In liquid electrolyte, repeated cycling induces severe particle pulverization and thick, unstable SEI growth. In contrast, the solid electrolyte configuration suppresses interfacial reactions, enabling a thin, stable SEI and improved structural integrity ...
Seokjin Kim, Jeongwoo Kim, Jaekyung Sung
wiley   +1 more source

ModBind_dG: A simulation-based absolute predictor of free energy of binding based on population reweighting. [PDF]

Proc Natl Acad Sci U S A
Sinko W, Mertz B, Terada Y, Kimura SR.
europepmc   +1 more source

A Generative Neuro‐Symbolic AI for Protein Sequence Design

Advanced Science, EarlyView.
We introduce EffieDes, a neuro‐symbolic framework coupling deep learning‐based fitness landscape parameterization with exact automated reasoning. Unlike greedy sampling, EffieDes identifies sequences that globally optimize fitness while satisfying intricate design constraints.
Marianne Defresne, Delphine Dessaux, Samuel Buchet, Lucie Barthe, Liza Ammar‐Khodja, Bessam Azizi, Valentin Durante, Gianluca Cioci, Simon de Givry, Alain Roussel, Luis F. Garcia‐Alles, Thomas Schiex, Sophie Barbe   +12 more
wiley   +1 more source

A spectral component approach leveraging identity-by-descent graphs to address recent population structure in genomic analysis. [PDF]

Genome Res
Shemirani R, Belbin GM, Cullina S, Caggiano C, Gignoux CR, Zaitlen N, Kenny EE.   +6 more
europepmc   +1 more source

Multiscale Modelling of the Electrocatalysis of Microenzymes: Insights Into the Performance of Microperoxidase at an Aqueous/Graphene Interface and Their Exploitation to Improve Performance

Advanced Science, EarlyView.
A novel multiscale MD/DFT framework to elucidate microenzyme adsorption and electron transfer is reported. This method reveals distinct configurations for microperoxidase‐11 on graphene and those best suited for electron transfer. Rate constants align with the limited experimental data, establishing this framework as a tool for optimizing microenzyme ...
Milan Mijajlovic, Cheng Hu, Yuhui Sun, Matthew J. Penna, Meisam V. Kiamahalleh, Wenrong Yang, Mark J. Biggs   +6 more
wiley   +1 more source

Visualizing health inequality data: guidance for selecting and designing graphs and maps. [PDF]

Int J Equity Health
Bergen N, Kirkby K, Nambiar D, Schlotheuber A, Hosseinpoor AR.   +4 more
europepmc   +1 more source

StackingNet: Collective Inference Across Independent AI Foundation Models

Advanced Science, EarlyView.
ABSTRACT Artificial intelligence (AI) built on large foundation models has transformed language understanding, computer vision, and reasoning, yet these systems remain isolated and cannot readily share their capabilities. Coordinating the complementary strengths of independently developed, black‐box foundation models is essential for trustworthy ...
Siyang Li, Chenhao Liu, Dongrui Wu, Zhigang Zeng, Lieyun Ding   +4 more
wiley   +1 more source

The Polytope Formalism: application to molecular constitution and the prospect of a complete description of Chemical Space. [PDF]

Chem Sci
Canfield PJ, Crossley MJ.
europepmc   +1 more source

Targeting GALNT7 Disrupts the TAZ O‐GalNAcylation Feedback Loop to Suppress Gallbladder Cancer Progression

Advanced Science, EarlyView.
Aberrant GALNT7‐mediated O‐GalNAcylation stabilizes TAZ to drive gallbladder cancer progression through a feed‐forward transcriptional loop. Structure‐based screening identifies Olaparib as a potent GALNT7 antagonist that disrupts this oncogenic axis, providing an immediate therapeutic strategy for this aggressive malignancy.
Peng Qiu, Ming Zhang, Yunxiang Feng, Yibo Deng, Kai Zhao, Xiangyu Li, Yun Lu, Li Tian, Tao Yang, Wei Yao, Jianming Wang, Zhengdong Deng   +11 more
wiley   +1 more source

Sudden restructuring of memory representations in recurrent neural networks with repeated stimulus presentations. [PDF]

Front Comput Neurosci
Howlett JR.
europepmc   +1 more source