Advanced Intelligent Discovery, EarlyView.Artificial intelligence is redefining network pharmacology (NP). By integrating knowledge graph engineering, geometric deep learning, multiomics anchoring, and generative reasoning, AI‐driven NP (AI‐NP) transforms static target mapping into dynamic, predictive modeling.
Cong Wang +9 more
wiley +1 more source
Transfer learning of GW Bethe-Salpeter equation excitation energies. [PDF]
Chem SciBaum D, Förster A, Visscher L.
europepmc +1 more source
Materials Representation Learning Based on a Material–Motif Network and Heterogeneous Graphs
Advanced Intelligent Discovery, EarlyView.Structure motifs in materials are used to construct a bipartite material–motif network that links each material to its constituent motifs and establishes connectivity among materials sharing common motifs. Network analysis reveals material clusters associated with different functional applications and supports motif‐guided screening of materials.
Anoj Aryal +3 more
wiley +1 more source
Monomeric CRP and negative acute phase proteins, but not pentameric CRP, as biomarkers of major depression and MDMD. [PDF]
Acta NeuropsychiatrAlmulla AF +4 more
europepmc +1 more source
Probing Machine Learning Interatomic Potentials on Ion Transport Properties
Advanced Intelligent Discovery, EarlyView.We perform a systematic benchmark of six state‐of‐the‐art universal machine learning interatomic potentials on their ability to predict ion transport properties in lithium‐ and sodium‐based superionic conductors relevant to all‐solid‐state batteries.
Ogheneyoma Aghoghovbia +2 more
wiley +1 more source
Conflict resolution tactics between mothers and children in a capital city in southeastern Brazil: prevalence and correlations. [PDF]
Rev Esc Enferm USPSilva LF, Leite FMC.
europepmc +1 more source
Pre‐Curved Everting Robots With Embedded Steering Intelligence Fabricated by CO2 Laser Welding
Advanced Intelligent Systems, EarlyView.Design and experimental demonstration of a laser welded growing robot for anatomically guided navigation. The robot follows an aortic arch phantom entering the branchiocephalic branch through steering by design. The figure shows the physical phantom setup, CAD defined weld geometry and full robot eversion.
Brandon Saldarriaga +5 more
wiley +1 more source
An Efficient Method for Contraction of Property-Oriented Basis Sets: A Considerable Reduction of the pecJ-1 and pecJ-2 Basis Sets for the Calculations of Spin-Spin Coupling Constants Involving H, C, N and F Nuclei. [PDF]
Int J Mol SciRusakova IL, Rusakov YY.
europepmc +1 more source