Biological and Physico-Chemical Characteristics of Arginine-Rich Peptide Gemini Surfactants with Lysine and Cystine Spacers. [PDF]
Int J Mol Sci, 2021 Neubauer D +6 more
europepmc +1 more source
Automating AI Discovery for Biomedicine Through Knowledge Graphs and Large Language Models Agents
Advanced Intelligent Discovery, EarlyView.This work proposes a novel framework that automates biomedical discovery by integrating knowledge graphs with multiagent large language models. A biologically aligned graph exploration strategy identifies hidden pathways between biomedical entities, and specialized agents use this pathway to iteratively design AI predictors and wet‐lab validation ...
Naafey Aamer +3 more
wiley +1 more source
Angewandte Chemie, EarlyView.Electronegativity‐guided site differentiation is realized in a CoNiCuMoW high‐entropy alloy, where Co/Ni sites optimize hydrogen binding strength, Mo/W sites promote water dissociation, and Cu‐associated sites contribute to balanced hydrogen adsorption.
Yutong Wu +7 more
wiley +2 more sources
Inhibitory influence of three new synthesized cationic gemini surfactants on the corrosion rate of carbon steel in 1 M HCl. [PDF]
Sci RepAbdelhafiz FM +3 more
europepmc +1 more source
Controllable enzymatic superactivity of α-chymotrypsin activated by the electrostatic interaction with cationic gemini surfactants. [PDF]
RSC Adv, 2021 Yue Z +6 more
europepmc +1 more source
Harnessing Digital Microstructure for Simulation‐Guided Optimization of Permanent Magnets
Advanced Intelligent Discovery, EarlyView.An experimental‐to‐computational workflow is presented that transforms experimental 3D focused ion beam‐scanning electron microscopy data into a simulation‐ready digital microstructure for multiphase functional materials. Using heavy‐rare‐earth‐free Nd–Fe–B magnets as a model system, the approach quantifies grain connectivity across complex secondary ...
Nikita Kulesh +4 more
wiley +1 more source
Autonomous AI‐Driven Design for Skin Product Formulations
Advanced Intelligent Discovery, EarlyView.This review presents a comprehensive closed‐loop framework for autonomous skin product formulation design. By integrating artificial intelligence‐driven experiment selection with automated multi‐tiered assays, the approach shifts development from trial‐and‐error to intelligent optimisation.
Yu Zhang +5 more
wiley +1 more source
In Situ Contact Angle Measurement for Autonomous Spin Coating in Self‐Driving Labs
Advanced Intelligent Discovery, EarlyView.A vision‐based add‐on transforms commercial spin coaters into autonomous modules of Self‐Driving Labs. Combining a width‐scaled U‐Net with classical geometric analysis, the system simultaneously measures contact angles and estimates substrate pose using a single camera.
Sven Fischer, Micha Hiegle, Holger Röhm
wiley +1 more source
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
Antimicrobial Activity of Gemini Surfactants with Azapolymethylene Spacer. [PDF]
Molecules, 2020 Kowalczyk I +3 more
europepmc +1 more source