Results 121 to 130 of about 84,108 (247)

BACH, a Bayesian Optimization Protocol for Accurate Coarse‐Grained Parameterization of Organic Liquids

Advanced Functional Materials, EarlyView.
We present a fully automated Bayesian optimization (BO) protocol for the parameterization of nonbonded interactions in coarse‐grain CG force fields (BACH). Using experimental thermophysical data, we apply the protocol to a broad range of liquids, spanning linear, branched, and unsaturated hydrocarbons, esters, triglycerides, and water.
Janak Prabhu, Akhil Pratap Singh, Pablo Campomanes, Stefano Vanni   +3 more
wiley   +1 more source

Routing and Scheduling in Time-Sensitive Networking by Evolutionary Algorithms. [PDF]

Biomimetics (Basel)
Wang Z, Liao W, Xia X, Wang Z, Duan Y.
europepmc   +1 more source

EEG Feature Extraction Using Evolutionary Algorithms for Brain-Computer Interface Development. [PDF]

Comput Intell Neurosci, 2022
Rocha-Herrera CA, Díaz-Manríquez A, Barron-Zambrano JH, Elizondo-Leal JC, Saldivar-Alonso VP, Martínez-Angulo JR, Nuño-Maganda MA, Polanco-Martagon S.   +7 more
europepmc   +1 more source

Single‐ and Dual‐Atom Configurations in Atomically Dispersed Catalysts for Lithium–Sulfur Batteries

Advanced Functional Materials, EarlyView.
Single‐atom and dual‐atom‐based atomically dispersed catalysts (ADCs) effectively address the shuttle effect and sluggish redox kinetics in Li–S batteries. With nearly 100% atomic utilization and tunable coordination environments, ADCs enhance LiPSs adsorption, lower conversion barriers, and accelerate sulfur redox reactions.
Haoyang Xu, Zhenfeng Li, Yue Fei, Ali Mohammadi, Ge Li   +4 more
wiley   +1 more source

Combining greedy and evolutionary algorithms to maximize influence in networks under deterministic linear threshold model. [PDF]

PLoS One
Andreev A, Kochemazov S, Semenov A.
europepmc   +1 more source

Identification of COVID-19 spread mechanisms based on first-wave data, simulation models, and evolutionary algorithms. [PDF]

PLoS One, 2022
Stanovov V, Grabljevec S, Akhmedova S, Semenkin E, Stojanović R, Rozman Č, Škraba A.   +6 more
europepmc   +1 more source

Elucidating the Role of Surface Ligands on the Oxidative Etching of Au Bipyramids During Photothermia Using Liquid Cell Transmission Electron Microscopy

Advanced Functional Materials, EarlyView.
Gold bipyramids can act as efficient plasmonic nanoheaters, but they often reshape during laser heating. This study shows that oxygen nanobubbles drive oxidative etching and that surface ligands control stability. CTAB‐ and citrate‐coated particles blunt and lose optical performance, whereas polystyrene sulfonate preserves shape and heating by ...
Irene López‐Sicilia, Valentina Girelli Consolaro, Sophie Marbach, Nancy Rahbany, Grégoire Petit, Ovidiu Ersen, Juan J. Giner‐Casares, Ali Abou‐Hassan   +7 more
wiley   +1 more source

Integrating evolutionary algorithms and enhanced-YOLOv8 + for comprehensive apple ripeness prediction. [PDF]

Sci Rep
Li Y, Wang Z, Yang A, Yu X.
europepmc   +1 more source

Multi‐Scale Interface Engineering of MXenes for Multifunctional Sensory Systems

Advanced Functional Materials, EarlyView.
MXenes, as two‐dimensional transition metal carbides and nitrides, demonstrate remarkable capabilities for multifunctional sensing applications. This review systematically examines multi‐scale interface engineering approaches that enhance sensing performance, enable diverse detection functionalities, and improve system‐level compatibility in MXene ...
Jiaying Liao, Sin‐Yi Pang, Jianhua Hao
wiley   +1 more source

Management and prediction of river flood utilizing optimization approach of artificial intelligence evolutionary algorithms. [PDF]

Sci Rep
Ikram RMA, Wang M, Moayedi H, Dehrashid AA.   +3 more
europepmc   +1 more source