Results 181 to 190 of about 2,997,816 (255)

The Interoperability Challenge in DFT Workflows Across Implementations

Advanced Intelligent Discovery, EarlyView.
Interoperability and cross‐validation remain major challenges in the computational materials science. In this work, we introduce a common input/output standard that enables internal translation across multiple workflow managers—AiiDA, PerQueue, Pipeline Pilot, and SimStack—while producing results in a unified schema.
Simon K. Steensen, Tushar Singh Thakur, Manuel Dillenz, Johan M. Carlsson, Celso R. C. Rêgo, Eibar Flores, Hamidreza Hajiyani, Felix Hanke, Juan María García Lastra, Wolfgang Wenzel, Nicola Marzari, Tejs Vegge, Giovanni Pizzi, Ivano E. Castelli   +13 more
wiley   +1 more source

Multisource Port Inspection Sensor Fusion with Causal Representation Learning for Cross-Border Anomaly Monitoring. [PDF]

Sensors (Basel)
Yin J, Lu Z, Xiong B, Sun K, Liu R, Liu Y, Li M.   +6 more
europepmc   +1 more source

Purpose Driven Competency Planning for Enterprise Modeling Projects

Much of the success of projects using Enterprise Modeling (EM) depends more on the quality of the process of modeling rather than on the method used. One important influence on the quality of the modeling process is the competency level of the experts ...
Persson, Anne, Stirna, Jānis
core  

AI‐Guided Co‐Optimization of Advanced Field‐Effect Transistors: Bridging Material, Device, and Fabrication Design

Advanced Intelligent Discovery, EarlyView.
This article outlines how artificial intelligence could reshape the design of next‐generation transistors as traditional scaling reaches its limits. It discusses emerging roles of machine learning across materials selection, device modeling, and fabrication processes, and highlights hierarchical reinforcement learning as a promising framework for ...
Shoubhanik Nath, Shauryaraj K. Jilkar, Aditya Udgaonkar, Yu (Joe) Lu, Ali Mesbah   +4 more
wiley   +1 more source

Pasture-based versus conventional broiler chicken production: Enterprise budget modeling and profitability analysis. [PDF]

Poult Sci
Alves LKS, Vukina T, Bartz BM, Eckberg JO, Pullin AN.   +4 more
europepmc   +1 more source

A Robust Deep Temporal Causal Discovery Platform for Single‐Cell Gene Regulatory Network Reconstruction

Advanced Intelligent Discovery, EarlyView.
scTIGER2.0 is a deep‐learning framework that infers gene regulatory networks from single‐cell RNA sequencing data. By integrating correlation, pseudotime ordering, deep learning and bootstrap‐based significance testing, it reduces false positives and reveals directional gene interactions.
Nishi Gupta, Madison Dautle, Shaoqiang Zhang, Yong Chen   +3 more
wiley   +1 more source

GSEA model outcomes in pharmaceutical workforce development: a retrospective pilot study (2023-2025). [PDF]

Front Public Health
Li S, Ma C.
europepmc   +1 more source

Application of Enterprise Modeling and Knowledge Management for Educational Information Technology in SMEs

Nowadays, an enterprise has to be flexible and adaptable to new market and rapidly changing global economic situations. Moreover, the global economic crisis has added an alarming dimension to this scenario and made the discovery of new solutions ...
Majore, Ginta, Majors, Ivars
core  

Crystal Structure Prediction of Inorganic Materials: A Benchmark and Modern Evaluation

Advanced Intelligent Discovery, EarlyView.
Predicting a crystal’s structure from composition alone is a long‐standing challenge in materials discovery. The CSP180 benchmark of 180 inorganic crystals evaluates thirteen crystal structure prediction algorithms requiring no density functional theory (DFT) against DFT‐based baselines across twelve metrics.
Lai Wei, Sadman Sadeed Omee, Rongzhi Dong, Nihang Fu, Yuqi Song, Edirisuriya M. Dilanga Siriwardane, Meiling Xu, Ming Hu, Chris Wolverton, Jianjun Hu   +9 more
wiley   +1 more source

Aligning for Impact: Opportunities for Health Care Organizations to Advance Broader Adoption of Value-Based Care. [PDF]

Perm J
Botts C, Vargo C.
europepmc   +1 more source