Výsledky vyhledávání - "Graph neural networks"

Enzyme specificity prediction using cross-attention graph neural networks.

Autoři: Cui H Su Y Dean TJ a další

Zdroj: Nature [Nature] 2025 Nov; Vol. 647 (8090), pp. 639-647. Date of Electronic Publication: 2025 Oct 08.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Nature Publishing Group Country of Publication: England NLM ID: 0410462 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1476-4687 (Electronic) Linking ISSN: 00280836 NLM ISO Abbreviation: Nature Subsets: MEDLINE

Výrazy ze slovníku MeSH: Enzymes*/metabolism , Enzymes*/chemistry , Graph Neural Networks*, Biocatalysis ; Catalytic Domain ; Databases, Protein ; Machine Learning ; Models, Molecular ; Reproducibility of Results ; Substrate Specificity

Glycolysis-compatible urethanases for polyurethane recycling.

Autoři: Chen Y Sun J Shi K a další

Zdroj: Science (New York, N.Y.) [Science] 2025 Oct 30; Vol. 390 (6772), pp. 503-509. Date of Electronic Publication: 2025 Oct 30.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: American Association for the Advancement of Science Country of Publication: United States NLM ID: 0404511 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1095-9203 (Electronic) Linking ISSN: 00368075 NLM ISO Abbreviation: Science Subsets: MEDLINE

Výrazy ze slovníku MeSH: Glycolysis* , Polyurethanes*/chemistry , Polyurethanes*/metabolism , Recycling* , Amidohydrolases*/chemistry , Graph Neural Networks* , Deep Learning*, Biocatalysis ; Enzyme Stability ; Hydrophobic and Hydrophilic Interactions

Morphometric similarity network-based graph convolutional networks for schizophrenia classification.

Autoři: Park HW Lee WH

Zdroj: Scientific reports [Sci Rep] 2025 Oct 16; Vol. 15 (1), pp. 36191. Date of Electronic Publication: 2025 Oct 16.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Nature Publishing Group Country of Publication: England NLM ID: 101563288 Publication Model: Electronic Cited Medium: Internet ISSN: 2045-2322 (Electronic) Linking ISSN: 20452322 NLM ISO Abbreviation: Sci Rep Subsets: MEDLINE

Výrazy ze slovníku MeSH: Schizophrenia*/diagnosis , Schizophrenia*/diagnostic imaging , Schizophrenia*/pathology , Graph Neural Networks* , Convolutional Neural Networks*, Humans ; Magnetic Resonance Imaging ; Datasets as Topic ; Brain/diagnostic imaging ; Male ; Female ; Adolescent ; Adult ; Middle Aged ; Aged

Enhancing explainable AI with graph signal processing: Applications in water distribution systems.

Autoři: Brentan BM Menapace A Oberascher M a další

Zdroj: Water research [Water Res] 2025 Oct 01; Vol. 285, pp. 124022. Date of Electronic Publication: 2025 Jul 05.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Pergamon Press Country of Publication: England NLM ID: 0105072 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1879-2448 (Electronic) Linking ISSN: 00431354 NLM ISO Abbreviation: Water Res Subsets: MEDLINE

Výrazy ze slovníku MeSH: Artificial Intelligence* , Water Supply* , Graph Neural Networks*

SecProGNN: Predicting Bronchoalveolar Lavage Fluid Secreted Protein Using Graph Neural Network.

Autoři: Shao D Zhang G Lin L a další

Zdroj: IEEE journal of biomedical and health informatics [IEEE J Biomed Health Inform] 2025 Aug; Vol. 29 (8), pp. 6114-6123.

Způsob vydávání: Comparative Study; Journal Article

Informace o časopise: Publisher: Institute of Electrical and Electronics Engineers Country of Publication: United States NLM ID: 101604520 Publication Model: Print Cited Medium: Internet ISSN: 2168-2208 (Electronic) Linking ISSN: 21682194 NLM ISO Abbreviation: IEEE J Biomed Health Inform Subsets: MEDLINE

Výrazy ze slovníku MeSH: Bronchoalveolar Lavage Fluid*/chemistry , Graph Neural Networks* , Multilayer Perceptrons* , Deep Learning* , Proteomics*/methods, Humans ; Biomarkers, Tumor/analysis ; Adenocarcinoma of Lung/diagnosis ; Lung Neoplasms/diagnosis

Generative and contrastive graph representation learning with message passing.

Autoři: Tang Y Yang Y Sun G

Zdroj: Neural networks : the official journal of the International Neural Network Society [Neural Netw] 2025 May; Vol. 185, pp. 107224. Date of Electronic Publication: 2025 Feb 06.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Pergamon Press Country of Publication: United States NLM ID: 8805018 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1879-2782 (Electronic) Linking ISSN: 08936080 NLM ISO Abbreviation: Neural Netw Subsets: MEDLINE

Výrazy ze slovníku MeSH: Graph Neural Networks* , Supervised Machine Learning*, Datasets as Topic ; Autoencoder ; Generative Artificial Intelligence

Graph neural networks for single-cell omics data: a review of approaches and applications.

Autoři: Li S Hua H Chen S

Zdroj: Briefings in bioinformatics [Brief Bioinform] 2025 Mar 04; Vol. 26 (2).

Způsob vydávání: Journal Article; Systematic Review

Informace o časopise: Publisher: Oxford University Press Country of Publication: England NLM ID: 100912837 Publication Model: Print Cited Medium: Internet ISSN: 1477-4054 (Electronic) Linking ISSN: 14675463 NLM ISO Abbreviation: Brief Bioinform Subsets: MEDLINE

Výrazy ze slovníku MeSH: Computational Biology*/methods , Genomics*/methods , Graph Neural Networks* , Single-Cell Analysis*/methods, Humans ; Deep Learning ; Epigenomics ; Neural Networks, Computer ; Proteomics/methods

Schizophrenia recognition based on three-dimensional adaptive graph convolutional neural network.

Autoři: Yin G Yuan J Chen Y a další

Zdroj: Scientific reports [Sci Rep] 2025 Feb 03; Vol. 15 (1), pp. 4067. Date of Electronic Publication: 2025 Feb 03.

Způsob vydávání: Journal Article; Research Support, Non-U.S. Gov't

Informace o časopise: Publisher: Nature Publishing Group Country of Publication: England NLM ID: 101563288 Publication Model: Electronic Cited Medium: Internet ISSN: 2045-2322 (Electronic) Linking ISSN: 20452322 NLM ISO Abbreviation: Sci Rep Subsets: MEDLINE

Výrazy ze slovníku MeSH: Schizophrenia*/diagnosis , Schizophrenia*/diagnostic imaging , Schizophrenia*/physiopathology , Graph Neural Networks* , Convolutional Neural Networks*, Humans ; Male ; Female ; Adult ; Algorithms ; Nerve Net/physiopathology ; Models, Neurological ; Electroencephalography

Transfer learning with graph neural networks for pressure estimation in monitoring-limited water distribution networks.

Autoři: Wang J Fu G Savic D

Zdroj: Water research [Water Res] 2025 Dec 01; Vol. 287 (Pt B), pp. 124475. Date of Electronic Publication: 2025 Aug 25.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Pergamon Press Country of Publication: England NLM ID: 0105072 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1879-2448 (Electronic) Linking ISSN: 00431354 NLM ISO Abbreviation: Water Res Subsets: MEDLINE

Výrazy ze slovníku MeSH: Neural Networks, Computer* , Water Supply* , Environmental Monitoring*/methods, Graph Neural Networks

Nonsuicidal self-injury prediction with pain-processing neural circuits using interpretable graph neural network.

Autoři: Wu S Xue Y Hang Y a další

Zdroj: Annals of medicine [Ann Med] 2025 Dec; Vol. 57 (1), pp. 2520394. Date of Electronic Publication: 2025 Jun 17.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Informa Healthcare Country of Publication: England NLM ID: 8906388 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1365-2060 (Electronic) Linking ISSN: 07853890 NLM ISO Abbreviation: Ann Med Subsets: MEDLINE

Výrazy ze slovníku MeSH: Self-Injurious Behavior*/physiopathology , Self-Injurious Behavior*/psychology , Self-Injurious Behavior*/diagnostic imaging , Nerve Net*/physiopathology , Nerve Net*/diagnostic imaging , Pain*/physiopathology , Brain*/physiopathology , Brain*/diagnostic imaging , Pain Perception*/physiology, Humans ; Male ; Female ; Adult ; Magnetic Resonance Imaging/methods ; Diffusion Tensor Imaging ; Young Adult ; Neural Networks, Computer ; Middle Aged ; Case-Control Studies ; Graph Neural Networks

An interpretable geometric graph neural network for enhancing the generalizability of drug-target interaction prediction.

Autoři: Xiong A Luo Z Xia Y a další

Zdroj: BMC biology [BMC Biol] 2025 Nov 26; Vol. 23 (1), pp. 350. Date of Electronic Publication: 2025 Nov 26.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: BioMed Central Country of Publication: England NLM ID: 101190720 Publication Model: Electronic Cited Medium: Internet ISSN: 1741-7007 (Electronic) Linking ISSN: 17417007 NLM ISO Abbreviation: BMC Biol Subsets: MEDLINE

Výrazy ze slovníku MeSH: Neural Networks, Computer* , Drug Discovery*/methods, Deep Learning ; Proteins/chemistry ; Proteins/metabolism ; Humans ; SARS-CoV-2 ; Graph Neural Networks

Cortical surface electric field estimation for real-time TMS with graph neural networks.

Autoři: Maki T Yokota T Hirata A a další

Zdroj: Physics in medicine and biology [Phys Med Biol] 2025 Nov 21; Vol. 70 (23). Date of Electronic Publication: 2025 Nov 21.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: IOP Publishing Country of Publication: England NLM ID: 0401220 Publication Model: Electronic Cited Medium: Internet ISSN: 1361-6560 (Electronic) Linking ISSN: 00319155 NLM ISO Abbreviation: Phys Med Biol Subsets: MEDLINE

Výrazy ze slovníku MeSH: Neural Networks, Computer* , Transcranial Magnetic Stimulation* , Electricity*, Humans ; Time Factors ; Magnetic Resonance Imaging ; Imaging, Three-Dimensional ; Surface Properties ; Graph Neural Networks

A dynamic ensemble learning model for robust Graph Neural Networks.

Autoři: Zhou C Peng Y Huang W a další

Zdroj: Neural networks : the official journal of the International Neural Network Society [Neural Netw] 2025 Nov; Vol. 191, pp. 107810. Date of Electronic Publication: 2025 Jul 07.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Pergamon Press Country of Publication: United States NLM ID: 8805018 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1879-2782 (Electronic) Linking ISSN: 08936080 NLM ISO Abbreviation: Neural Netw Subsets: MEDLINE

Výrazy ze slovníku MeSH: Machine Learning* , Neural Networks, Computer*, Algorithms ; Ensemble Learning ; Game Theory ; Graph Neural Networks

Learning model-level explanations of graph neural networks via subgraph order embedding space.

Autoři: Liu L Wan P Zhang F a další

Zdroj: Neural networks : the official journal of the International Neural Network Society [Neural Netw] 2025 Nov; Vol. 191, pp. 107815. Date of Electronic Publication: 2025 Jul 05.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Pergamon Press Country of Publication: United States NLM ID: 8805018 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1879-2782 (Electronic) Linking ISSN: 08936080 NLM ISO Abbreviation: Neural Netw Subsets: MEDLINE

Výrazy ze slovníku MeSH: Neural Networks, Computer* , Machine Learning*, Humans ; Algorithms ; Graph Neural Networks

From matrix factorization to graph neural networks: Advances in computational drug repositioning.

Autoři: Wang Y Wang J Yang Y a další

Zdroj: Drug discovery today [Drug Discov Today] 2025 Nov; Vol. 30 (11), pp. 104499. Date of Electronic Publication: 2025 Oct 10.

Způsob vydávání: Journal Article; Review

Informace o časopise: Publisher: Elsevier Science Ltd. Country of Publication: England NLM ID: 9604391 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1878-5832 (Electronic) Linking ISSN: 13596446 NLM ISO Abbreviation: Drug Discov Today Subsets: MEDLINE

Výrazy ze slovníku MeSH: Drug Repositioning*/methods , Neural Networks, Computer* , Computational Biology*/methods, Humans ; Artificial Intelligence ; Drug Discovery/methods ; Animals ; Computer Simulation ; Graph Neural Networks

Path-aware multi-scale learning for heterogeneous graph neural network.

Autoři: Fan J Yang J Gu Z a další

Zdroj: Neural networks : the official journal of the International Neural Network Society [Neural Netw] 2025 Nov; Vol. 191, pp. 107743. Date of Electronic Publication: 2025 Jun 21.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Pergamon Press Country of Publication: United States NLM ID: 8805018 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1879-2782 (Electronic) Linking ISSN: 08936080 NLM ISO Abbreviation: Neural Netw Subsets: MEDLINE

Výrazy ze slovníku MeSH: Neural Networks, Computer* , Machine Learning*, Humans ; Algorithms ; Graph Neural Networks

DeepEGFR a graph neural network for bioactivity classification of EGFR inhibitors.

Autoři: Malik AA Khyriem C Hauns S a další

Zdroj: Scientific reports [Sci Rep] 2025 Oct 31; Vol. 15 (1), pp. 38236. Date of Electronic Publication: 2025 Oct 31.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Nature Publishing Group Country of Publication: England NLM ID: 101563288 Publication Model: Electronic Cited Medium: Internet ISSN: 2045-2322 (Electronic) Linking ISSN: 20452322 NLM ISO Abbreviation: Sci Rep Subsets: MEDLINE

Výrazy ze slovníku MeSH: ErbB Receptors*/antagonists & inhibitors , ErbB Receptors*/metabolism , Protein Kinase Inhibitors*/pharmacology , Protein Kinase Inhibitors*/chemistry , Protein Kinase Inhibitors*/classification , Neural Networks, Computer* , Antineoplastic Agents*/pharmacology , Antineoplastic Agents*/chemistry, Humans ; Machine Learning ; Algorithms ; Graph Neural Networks

Prediction of peptide cleavage sites using protein language models and graph neural networks.

Autoři: Cifuentes P Adàlia R Zamora I

Zdroj: Scientific reports [Sci Rep] 2025 Oct 30; Vol. 15 (1), pp. 38048. Date of Electronic Publication: 2025 Oct 30.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Nature Publishing Group Country of Publication: England NLM ID: 101563288 Publication Model: Electronic Cited Medium: Internet ISSN: 2045-2322 (Electronic) Linking ISSN: 20452322 NLM ISO Abbreviation: Sci Rep Subsets: MEDLINE

Výrazy ze slovníku MeSH: Neural Networks, Computer* , Peptides*/chemistry , Peptides*/metabolism , Proteins*/chemistry, Algorithms ; Machine Learning ; Computer Simulation ; Computational Biology/methods ; Amino Acids/chemistry ; Proteolysis ; Peptides, Cyclic/chemistry ; Graph Neural Networks

Sports injury risk prediction based on temporal graph encoding and graph neural networks: A cross-sport transfer learning framework.

Autoři: Fang D Chen C

Zdroj: Scientific reports [Sci Rep] 2025 Oct 28; Vol. 15 (1), pp. 37656. Date of Electronic Publication: 2025 Oct 28.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Nature Publishing Group Country of Publication: England NLM ID: 101563288 Publication Model: Electronic Cited Medium: Internet ISSN: 2045-2322 (Electronic) Linking ISSN: 20452322 NLM ISO Abbreviation: Sci Rep Subsets: MEDLINE

Výrazy ze slovníku MeSH: Athletic Injuries*/epidemiology , Neural Networks, Computer*, Humans ; Risk Factors ; Athletes ; Male ; Machine Learning ; Risk Assessment/methods ; Female ; Sports ; Graph Neural Networks

Toxigraphnet: a graph neural network framework for precise toxicity prediction of drug molecules.

Autoři: Chotaliya M Agrawal SS

Zdroj: Journal of computer-aided molecular design [J Comput Aided Mol Des] 2025 Oct 24; Vol. 39 (2), pp. 101. Date of Electronic Publication: 2025 Oct 24.

Způsob vydávání: Journal Article

Informace o časopise: Publisher: Springer Country of Publication: Netherlands NLM ID: 8710425 Publication Model: Electronic Cited Medium: Internet ISSN: 1573-4951 (Electronic) Linking ISSN: 0920654X NLM ISO Abbreviation: J Comput Aided Mol Des Subsets: MEDLINE

Výrazy ze slovníku MeSH: Neural Networks, Computer* , Drug-Related Side Effects and Adverse Reactions*, Pharmaceutical Preparations/chemistry ; Quantitative Structure-Activity Relationship ; Humans ; Algorithms ; Lethal Dose 50 ; Graph Neural Networks