Results 111 to 120 of about 264,591 (190)

Hierarchical Network Organization and Dynamic Perturbation Propagation in Autism Spectrum Disorder: An Integrative Machine Learning and Hypergraph Analysis Reveals Super-Hub Genes and Therapeutic Targets. [PDF]

Biomedicines
Batrancea LM, Akgüller Ö, Balcı MA, Gaban L.   +3 more
europepmc   +1 more source

Topology‐Aware Machine Learning for High‐Throughput Screening of MOFs in C8 Aromatic Separation

Advanced Intelligent Discovery, EarlyView.
We screened 15,335 Computation‐Ready, Experimental Metal–Organic Frameworks (CoRE‐MOFs) using a topology‐aware machine learning (ML) model that integrates structural, chemical, pore‐size, and topological descriptors. Top‐performing MOFs exhibit aromatic‐enriched cavities and open metal sites that enable π–π and C–H···π interactions, serving as ...
Yu Li, Honglin Li, Jialu Li, Wan‐Lu Li
wiley   +1 more source

Vortex beam nanofocusing and optical skyrmion generation via hyperbolic metamaterials. [PDF]

Nanophotonics
Li W, LaMountain J, Simmons E, Tan J, Barati Sedeh H, Clabeau A, Bekele RY, Myers JD, Omatsu T, Frantz J, Podolskiy VA, Litchinitser NM.   +11 more
europepmc   +1 more source

Deep Learning‐Assisted Design of Mechanical Metamaterials

Advanced Intelligent Discovery, EarlyView.
This review examines the role of data‐driven deep learning methodologies in advancing mechanical metamaterial design, focusing on the specific methodologies, applications, challenges, and outlooks of this field. Mechanical metamaterials (MMs), characterized by their extraordinary mechanical behaviors derived from architected microstructures, have ...
Zisheng Zong, Pu Wen, Zhiping Chai, Dunxuan Wu, Han Ding, Zhigang Wu   +5 more
wiley   +1 more source

Deep learning of conversation-based 'filmstrips' for robust Alzheimer's disease detection. [PDF]

NPJ Aging
Trognon A, Duman C, Vittart G, Stortini N, Mahdar-Recorbet L, Altakroury H.   +5 more
europepmc   +1 more source

Accelerating Primary Screening of USP8 Inhibitors from Drug Repurposing Databases with Tree‐Based Machine Learning

Advanced Intelligent Discovery, EarlyView.
This study introduces a tree‐based machine learning approach to accelerate USP8 inhibitor discovery. The best‐performing model identified 100 high‐confidence repurposable compounds, half already approved or in clinical trials, and uncovered novel scaffolds not previously studied. These findings offer a solid foundation for rapid experimental follow‐up,
Yik Kwong Ng, Sharon Ai Er Lam, Wei Chun Lim, Hannah Hui Min Toh, Shi Jun Ang   +4 more
wiley   +1 more source

Machine Learning the Decoherence Property of Superconducting and Semiconductor Quantum Devices from Graph Connectivity. [PDF]

Entropy (Basel)
Fu Q, Liu J, Wang X, Xiong R.
europepmc   +1 more source

Interpretability and Representability of Commutative Algebra, Algebraic Topology, and Topological Spectral Theory for Real‐World Data

Advanced Intelligent Discovery, EarlyView.
This article investigates how persistent homology, persistent Laplacians, and persistent commutative algebra reveal complementary geometric, topological, and algebraic invariants or signatures of real‐world data. By analyzing shapes, synthetic complexes, fullerenes, and biomolecules, the article shows how these mathematical frameworks enhance ...
Yiming Ren, Guo‐Wei Wei
wiley   +1 more source

Drug screening for α-synuclein aggregation inhibitors via multimodal graph neural network. [PDF]

Brief Bioinform
Gu T, Ran Z, Li W, Guo X, Li B, Li F, Jia C.   +6 more
europepmc   +1 more source

Holographic Mapping of Orbital Angular Momentum using a Terahertz Diffractive Optical Neural Network

Advanced Intelligent Discovery, EarlyView.
A compact six‐layer diffractive optical neural network enables direct recognition and spatial mapping of terahertz (THz) orbital angular momentum (OAM) beams. Fabricated by 3D printing, the system distinguishes nine OAM modes and their superpositions with high fidelity, good efficiency, and low crosstalk, offering a scalable solution for THz ...
Wei Jia, Miguel Gomez, Steve Blair, Berardi Sensale‐Rodriguez   +3 more
wiley   +1 more source