Results 171 to 180 of about 2,023,011 (261)

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

Aromaticity switching by quantum tunnelling. [PDF]

Chem Sci
Rodríguez-Sotelo SJ, Santoyo-Flores JJ, Młodzikowska-Pieńko K, Poranne RG, Kozuch S.   +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

Synthetic Comparative Analysis of Cardiovascular Disease Profiles Using Quantum Information Measures in Indian and Global Populations. [PDF]

Diagnostics (Basel)
Sahoo SK, Mohapatra SK, Mohapatra SK, Prabha C, Mohanty J, Sahadevan D, Yogarayan S, Balusamy B.   +7 more
europepmc   +1 more source

A Compact, High‐Performance, and Deformation‐Resilient Trielectrode Electrostatic Soft Pump for Soft Robotics

Advanced Intelligent Systems, Volume 7, Issue 3, March 2025.
Existing soft pumps often require tradeoffs between performance and compatibility with soft robotic systems. The proposed trielectrode electrostatic soft pump addresses these limitations through an innovative driving mechanism. Its design, which includes a trielectrode configuration and the use of compliant materials, improves operational efficiency ...
Yangqiao Lin, Xiaoli Yang, Tao Jin, Jieyu Wang, Sicheng Yi, Yue Wang, Songyi Zhong, Tao Yue, Quan Zhang, Yingzhong Tian, Long Li   +10 more
wiley   +1 more source

Human mobility and outbreak origins in epidemic spread: Insights from agent-based modeling. [PDF]

PLoS Comput Biol
Klochkov KA, Kozlov IE, Ilina EN, Manolov AI.   +3 more
europepmc   +1 more source

Robust Reinforcement Learning Control Framework for a Quadrotor Unmanned Aerial Vehicle Using Critic Neural Network

Advanced Intelligent Systems, Volume 7, Issue 3, March 2025.
Quadrotor unmanned aerial vehicle control is critical to maintain flight safety and efficiency, especially when facing external disturbances and model uncertainties. This article presents a robust reinforcement learning control scheme to deal with these challenges.
Yu Cai, Yefeng Yang, Tao Huang, Boyang Li   +3 more
wiley   +1 more source

Rectal cancer segmentation via HHF-SAM: a hierarchical hypercolumn-guided fusion segment anything model. [PDF]

Front Artif Intell
Wang Y, Yang Y, Wu X, Feng Z, Wang C.
europepmc   +1 more source

Interpretable Short‐Term Electric Load Forecasting

Advanced Intelligent Systems, EarlyView.
A temporal fusion transformer is implemented to generate day‐ahead forecasts of the hourly electrical load of a departmentbuilding at an Italian university. A forecasting performance improvement of more than 25% compared with established benchmark models and a provision of inherent robust interpretability insights reveal the potential of this model for
Alessandro Nicola, Giorgia Ghione, Vincenzo Randazzo, Vincenzo Franzitta, Marco Badami, Eros Pasero, Giansalvo Cirrincione   +6 more
wiley   +1 more source

Dynamic Balance: A Thermodynamic Principle for the Emergence of the Golden Ratio in Open Non-Equilibrium Steady States. [PDF]

Entropy (Basel)
Ruiz A.
europepmc   +1 more source