Results 211 to 220 of about 35,400 (266)

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

Wavenumber-space wavefront sensorless adaptive-optics for optical coherence tomography. [PDF]

Biomed Opt Express
Ruiz-Lopera S, Veysset D, Bouma BE, Uribe-Patarroyo N.   +3 more
europepmc   +1 more source

LL‐37 Driven Phase Transition and Stacking in Oligolamellar Gram‐Negative Bacterial Membrane Models

Advanced Functional Materials, EarlyView.
This work establishes oligolamellar bacterial membrane models to investigate how LL‐37 disrupts the complex dual‐bilayer architecture of Gram‐negative bacteria. Combining SAXS, cryo‐TEM, electrophoretic mobility measurements, and coarse‐grained simulations, it reveals cardiolipin‐driven phase transitions leading to bicelle‐like structures and membrane ...
Bettina Tran, Diane C.A. Lima, Linda Sandblad, Madeleine Ramstedt, Thereza A. Soares, Stefan Salentinig   +5 more
wiley   +1 more source

Comprehensive evaluation of EEG spatial sampling, head modelling and parcellation effects on network alterations in idiopathic generalized epilepsy. [PDF]

Brain Commun
Stier C, Loose M, Loew C, Segovia-Oropeza M, Baek S, Lerche H, Focke NKN.   +6 more
europepmc   +1 more source

Inducing Ferromagnetism by Structural Engineering in a Strongly Spin‐Orbit Coupled Oxide

Advanced Functional Materials, EarlyView.
ABSTRACT Magnetic materials with strong spin‐orbit coupling (SOC) are essential for the advancement of spin‐orbitronic devices, as they enable efficient spin‐charge conversion, complex magnetic structures, spin‐valley physics, topological phases and other exotic phenomena.
Ji Soo Lim, Carmine Autieri, Merit Spring, Martin Kamp, Amar Fakhredine, Pavel Potapov, Daniel Wolf, Sergii Pylypenko, Axel Lubk, Johannes Schultz, Nicolas Perez, Börge Mehlhorn, Louis Veyrat, Mario Cuoco, Fadi Choueikan, Philippe Ohresser, Bernd Büchner, Giorgio Sangiovanni, Ralph Claessen, Michael Sing   +19 more
wiley   +1 more source

Logarithmic Scaling of Loss Functions for Enhanced Self-Supervised Accelerated MRI Reconstruction. [PDF]

Diagnostics (Basel)
Cho J.
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

Differential geometry-based harmonic analysis of three-phase systems. [PDF]

Sci Rep
Sundriyal N, Thakur P, Dixit A, Gupta S, Kumar M.   +4 more
europepmc   +1 more source

Is chronological age predictable on panoramic images using the Demirjian method on third molars? Insights from a Turkish population-based study. [PDF]

Med Oral Patol Oral Cir Bucal
Tas A, Agbulut N, Oztoprak Y, Aydin K.
europepmc   +1 more source

Enhancing clinical insights in glioma grading using Bayesian Optimization and Explainable AI. [PDF]

J Genet Eng Biotechnol
Elsayad AM, Elsayad OA.
europepmc   +1 more source