Toward Full Interoperability in Materials Science: Integrating Workflows With Knowledge Graphs
The connection of conceptual workflow design, portable execution, and ontology‐based semantics leading to provenance‐rich knowledge graphs are main contributors to interoperability in materials science and a prerequisite to AI‐assisted orchestration and for interoperable Materials Acceleration Platforms.
Jan Janssen +14 more
wiley +1 more source
Three-dimensional dynamic simulation-assisted thoracoscopic complex right S7+S10 segmentectomy. [PDF]
Rojas D, Pfeuty K.
europepmc +1 more source
Effects of Mg on Microstructure and Solidification of a Hypereutectic Zn–8 wt.%Al Alloy
An appreciable set of results involving thermal data, microstructure, chemical composition, and microstructural growth laws is reported for ZnAlMg alloys. Such results demonstrate that ZnAlMg alloys have high potential for applications in automotive self‐lubricating components, batteries, and electrical systems.
Raí B. de Sousa +6 more
wiley +1 more source
Multimodal modeling of emotion regulation in interactive art therapy: EEG and PANAS-based dynamic simulation. [PDF]
Chen X, Zeng M.
europepmc +1 more source
Supporting AI Readiness Through Digital Workflows in Materials Science
Digitalization drives innovation in materials science by connecting data silos and turning heterogeneous processes into reusable research pipelines. Across 13 MaterialDigital projects, digital workflows reveal complementary pathways toward AI‐ready materials research, founded on structured data, persistent artifacts, executable orchestration, and ...
Marian Bruns +67 more
wiley +1 more source
PTGS2 and KPNA2 as key mediators of DEHP-induced osteoarthritis: From network prediction to machine learning and dynamic simulation validation. [PDF]
Wang F +8 more
europepmc +1 more source
A Multi‐Scale Machine Learning Framework for the Inverse Design of High Entropy Alloys
High‐entropy alloys offer vast potential for various applications, including electrocatalysis; however, their compositional complexity challenges conventional screening. We introduce an inverse‐design framework combining two neural networks to determine optimal compositions and reconstruct nanoparticle geometry from targeted properties and conventional
Mikael Takoutsin +14 more
wiley +1 more source
A Society of Simulation Approach to Dynamic Integration of Simulations [PDF]
openaire +2 more sources
Exploration of novel hydroxamic acid-based candidates integrating chalcone scaffold cap as multitarget HDAC inhibitors: design, anti-prostatic cancer assessment, <i>in silico</i> docking and molecular dynamic simulation. [PDF]
I Abd El-Hameed A +10 more
europepmc +1 more source
Enhancing Low‐Temperature Performance of Sodium‐Ion Batteries via Anion‐Solvent Interactions
DOL is introduced into electrolytes as a co‐solvent, increasing slat solubility, ion conductivity, and the de‐solvent process, and forming an anion‐rich solvent shell due to its high interaction with anion. With the above virtues, the batteries using this electrolyte exhibit excellent cycling stability at low temperatures. Abstract Sodium‐ion batteries
Cheng Zheng +7 more
wiley +1 more source

