Results 71 to 80 of about 34,625 (268)

Interface‐Mediated Catalysis for Improved Hydrogen Storage in Reactive Hydride Composites

open access: yesAdvanced Materials, EarlyView.
Catalyst–hydride interfaces are engineered in Co@C‐ and Ni@C‐modified 2LiH + MgB2 reactive hydride composites to accelerate hydrogen uptake and release. Multiscale scattering, in‐situ synchrotron radiation powder x‐ray diffraction and density functional theory calculations reveal the structural and electronic origin of the catalytic enhancement ...
Yuanyuan Shang   +12 more
wiley   +1 more source

Structural and Dynamic Properties of Lipid‐Coated Gold Nanoparticles

open access: yesAdvanced Materials Interfaces, EarlyView.
Atomistic molecular dynamics simulations reveal how lipid chemistry governs the behavior of coatings on the surface of a gold nanoparticle. Variations in headgroup charge and acyl‐chain saturation produce distinct monolayer‐like lipid organization, ranging from compact, ordered coatings to extended, dynamic shells. These findings establish a foundation
Kalpani A. Mirihana   +4 more
wiley   +1 more source

A denoising method for concrete cracking electromagnetic signals based on grey wolf optimized VMD-WT

open access: yesDiance yu yibiao
In the moment of concrete cracking, electromagnetic signals are generated due to the oscillation of surface charges on the cracks. Aiming at the issue of electromagnetic signals being susceptible to environmental noise interference and having a low ...
HOU Chunyao   +6 more
doaj   +1 more source

Anomalies, VMD and the Enjl Model

open access: yes, 1993
8 pages, plain LaTeX, preprint NORDITA - 93/69 N,P and NBI-93 ...
Bijnens, Johan, Prades, Joaquim
openaire   +2 more sources

Explainable Spectrum Prediction Based on VMD-LSTM [PDF]

open access: yes
To improve the accuracy and interpretability of neural network enabled spectrum prediction, an explainable spectrum prediction framework based on Variational Mode Decomposition (VMD) and Long Short-Term Memory (LSTM) networks, integrated with the Shapley
Xu, W., Su, Z., Zhang, J.
core   +1 more source

Ultra‐Radiostable Covalent Conformationally Interlocked Networks Enabling a Universal Radiometal‐Labeling Platform for Cancer Radioembolization

open access: yesAdvanced Science, EarlyView.
Conjugated poly(imide dioxime)‐based microspheres establish a radiometal coordination‐driven conformational interlocked network with ultra‐high radiostability. This platform enables low‐temperature, multi‐radionuclide labeling for SPECT/PET/MRI imaging and radionuclide therapy. Mechanistic insights from EXAFS and DFT reveal enhanced stability, while in
Xiao Xu   +10 more
wiley   +1 more source

Backbone Steric Constraints Underlie High Passive Membrane Permeability of N‐Alkyl Peptides

open access: yesAngewandte Chemie, EarlyView.
Beyond amide hydrogen removal, steric constraints encoded in N/Cα‐dually substituted backbones are uncovered as a key determinant of passive membrane permeability in N‐alkyl peptides. These constraints restrict conformational freedom and sterically limit backbone hydration during membrane permeation.
Ayumi Inayoshi   +8 more
wiley   +2 more sources

A customised 1D-CNN for recognition of freezing of gait in Parkinson’s disease using multivariate decomposition techniques

open access: yesOpen Computer Science
The freezing of gait (FoG) presents a sudden challenge in sustaining movement which becomes a common gait issue in people with later stages of Parkinson’s disease (PD). FoG often results in falls that reduces the individual’s impact on life.
Rajendran Nancy   +4 more
doaj   +1 more source

VMD Documentation

open access: yes, 2018
In this documentation, the basic and intermediate documentation of VMD molecular dynamics visualization software from University of Illinois at Urbana-Champaign are provided. This documentation includes user guide for opening and loading molecular structure files, change drawing options of molecular structures like CPK, tube, ribbon and etc., change ...
openaire   +2 more sources

Flow of SSA-VMD-WST model.

open access: yes
In view of the strong randomness and non-stationarity of complex system, this study suggests a hybrid multi-strategy prediction technique based on optimized hybrid denoising and deep learning.
Xinyi Xu (505530)   +2 more
core   +1 more source

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