Results 241 to 250 of about 4,904 (291)

Underwater Sensor Networks for Communication, Navigation, and Localization. [PDF]

Sensors (Basel)
Ullah I.
europepmc   +1 more source

Effect of Atomic Charges on C2H2/CO2/CH4 Separation Performances of Covalent‐Organic Framework Adsorbents

Advanced Theory and Simulations, EarlyView.
Three charge assignment approaches (one quantum chemistry method‐based, the other two machine‐learning (ML) model‐based) are employed to investigate acetylene separation performances of experimental covalent‐organic frameworks. Partial Atomic Charge Predicter for Porous Materials based on Graph Convolutional Neural Network (PACMAN) ML model‐based ...
Hakan Demir, Ilknur Erucar
wiley   +1 more source

Soul Men and Women-what must science do to regain public trust? [PDF]

EMBO Rep
Caplan A.
europepmc   +1 more source

Excitation Energy Transfer between Porphyrin Dyes on a Clay Surface: A Study Employing Multifidelity Machine Learning

Advanced Theory and Simulations, EarlyView.
Inspired by natural light‐harvesting systems, this study computationally investigates a synthetic antenna by arranging cationic free‐base porphyrin molecules on an anionic clay surface. Using a multiscale quantum mechanics/molecular mechanics (QM/MM) approach combined with a multifidelity machine learning method, excitation energies are predicted ...
Dongyu Lyu, Vivin Vinod, Matthias Holzenkamp, Yannick Marcel Holtkamp, Sayan Maity, Carlos R. Salazar, Ulrich Kleinekathöfer, Peter Zaspel   +7 more
wiley   +1 more source

A formal statechart model of immediate neonatal adaptation guidelines. [PDF]

Heliyon
Sepúlveda-Oviedo EH, Bermeo Clavijo LE, Carlos Méndez-Córdoba L.   +2 more
europepmc   +1 more source

Role of the Setae in an Ectoparasitic Seal Louse in Reducing Surface Drag: Numerical Modeling Approach

Advanced Theory and Simulations, EarlyView.
The seal louse Echinophthirius horridus has uniquely shaped setae that may reduce drag during its host's dives. Using numerical simulations, this study demonstrates that their natural inclination promotes vortex formation, minimizing friction and energy loss. These findings provide insights into biological surface adaptations and may inspire the design
Anika Preuss, Stanislav N. Gorb, Alexander Kovalev, Alexander E. Filippov   +3 more
wiley   +1 more source

Guesstimation of Molecular Ensemble Electrostatics Properties Through SCERPA‐DFT Calculation: Molecular Field‐Coupled Nanocomputing as a Case Study

Advanced Theory and Simulations, EarlyView.
This work presents a framework combining the Self‐Consistent Electrostatic Potential Algorithm (SCERPA) and Density‐Functional Theory calculations to efficiently evaluate the electronic properties of molecular ensembles. The approach achieves ab initio‐comparable precision while significantly reducing computation time and provides the first DFT ...
Yuri Ardesi, Fabrizio Mo, Marco Vacca, Gianluca Piccinini, Mariagrazia Graziano   +4 more
wiley   +1 more source

Bio-inspired cryptography based on proteinoid assemblies. [PDF]

PLoS One
Mougkogiannis P, Ghadafi E, Adamatzky A.
europepmc   +1 more source

Lecithin Alleviates Memory Deficits and Muscle Attenuation in Chinese Older Adults and SAMP8 Mice

Advanced Science, EarlyView.
This study opens a new avenue for safeguarding cognition and muscle health, averting disability in older age, and treating age‐related pathologies through lecithin supplementation. It serves as a promising nonpharmacological intervention for the crosstalk of muscle and cognition.
Xianyun Wang, Dajun Li, Xiao Ying Li, Weizhao Lu, Huini Ding, Chengyan Qi, Xuan Wang, Jing Shen, Yafei Chi, Tiantian Li, Michelle M. Dunk, Yu An, Hongmei Huang, Kang Yu, Weili Xu, Rong Xiao, Yuandi Xi   +16 more
wiley   +1 more source

Extract, model, refine: improved modelling of program verification tools through data enrichment. [PDF]

Softw Syst Model
Lathouwers S, Liu Y, Zaytsev V.
europepmc   +1 more source