Results 41 to 50 of about 31,978 (281)

Enhancing Low‐Temperature Performance of Sodium‐Ion Batteries via Anion‐Solvent Interactions

open access: yesAdvanced Functional Materials, EarlyView.
DOL is introduced into electrolytes as a co‐solvent, increasing slat solubility, ion conductivity, and the de‐solvent process, and forming an anion‐rich solvent shell due to its high interaction with anion. With the above virtues, the batteries using this electrolyte exhibit excellent cycling stability at low temperatures. Abstract Sodium‐ion batteries
Cheng Zheng   +7 more
wiley   +1 more source

jvermaas/vmd-tprreader: GROMACS 2023

open access: yes, 2023
This is the version that works with GROMACS 2023, which added some new "features" for me to reverse ...
liuyujie714, Josh Vermaas
core   +1 more source

Clusterization‐Triggered Emission from Cellulose‐Based Luminophores in Dilute Aqueous Solution through Imine Formation

open access: yesAdvanced Functional Materials, EarlyView.
Clusterization‐triggered emission is realized in dilute aqueous solution by introducing imine linkages into cellulose‐based luminophores. Imine functionalization creates O/N‐rich, hydrogen‐bonded clustered microenvironments that stabilize emissive states and restrict molecular motions. Luminescence is tunable by amine type and multiplicity.
Yazhou Su   +5 more
wiley   +1 more source

Light‐Activatable Nitric Oxide Release via Intramolecular Electron Transfer for Tumor Pyroptosis Induction

open access: yesAdvanced Science, EarlyView.
This work proposes a novel strategy to fabricate unimolecular pyroptosis photoinitiators activated by deep‐red light at low light doses. It relies on a photosensitization mechanism to trigger nitric oxide (NO) release from benzisothiadiazole‐based N‐nitrosanilines without modification of nitro moieties, thereby boosting pyroptosis‐mediated ...
Chuangxin Zhang   +4 more
wiley   +1 more source

Visualisation of cyclic and multi-branched molecules with VMD [PDF]

open access: yesJournal of Molecular Graphics and Modelling, 2009
We report the addition of two visualisation algorithms, termed PaperChain and Twister, to the freely available Visual Molecular Dynamics (VMD) package. These algorithms produce visualisations of complex cyclic molecules and multi-branched polysaccharides and are a generalization and optimization of those we previously developed in a standalone package ...
Simon, Cross   +3 more
openaire   +2 more sources

VMD–WT-Based Method for Extracting On-the-Fly GNSS Tide Level and Its Realization

open access: yes, 2022
In this paper, a method for extracting the on-the-fly (OTF) GNSS tide level was designed by combining variational modal decomposition (VMD) and a wavelet thresholding (WT) method to improve the extraction accuracy of the OTF GNSS tide level.
Lei Wang   +3 more
core   +1 more source

A Computational Strategy for Identifying Self‐Assembling Food‐Derived Molecules for Antiparasitic Nanotherapy

open access: yesAdvanced Science, EarlyView.
An integrated computational screening strategy identified ursolic acid (UA) and 18β‐glycyrrhetinic acid (18βGA) as a self‐assembling food‐derived molecular pair. The resulting carrier‐free nanoparticles (UA‐18βGA) showed synergistic antiparasitic activity, reduced combined toxicity, and host‐protective anti‐inflammatory effects in zebrafish and murine ...
Shenye Qu   +8 more
wiley   +1 more source

Dynamic Prediction Model of Crop Canopy Temperature Based on VMD-LSTM

open access: yes智慧农业
[Objective]Accurate prediction of crop canopy temperature is essential for comprehensively assessing crop growth status and guiding agricultural production.
WANG Yuxi, HUANG Lyuwen, DUAN Xiaolin
doaj   +1 more source

Sample predicted output samples with VMD-ALO-DLFTSVM predictor.

open access: yes, 2022
Sample predicted output samples with VMD-ALO-DLFTSVM predictor.
Jaikumar S. (13813296)   +3 more
core   +1 more source

Flexible Unusual Ternary‐Component Graded‐Modulus Dielectric Films with High‐Density Capacitive Energy Storage

open access: yesAdvanced Science, EarlyView.
Hierarchical PP–LSR107–BaTiO3 nanocomposite films are fabricated by one‐step extrusion and stretching for roll‐to‐roll manufacture, combining high energy storage and processing flexibility. LSR107 surrounds BaTiO3‐rich regions, locating amorphous PP, decreasing defects, and introducing deep traps that homogenize the electric field and suppress charge ...
Yi Gao   +14 more
wiley   +1 more source

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