Results 181 to 190 of about 103,432 (283)

Artificial Intelligence for Multiscale Modeling in Solid‐State Physics and Chemistry: A Comprehensive Review

open access: yesAdvanced Intelligent Systems, EarlyView.
This review explores the transformative impact of artificial intelligence on multiscale modeling in materials research. It highlights advancements such as machine learning force fields and graph neural networks, which enhance predictive capabilities while reducing computational costs in various applications.
Artem Maevskiy   +2 more
wiley   +1 more source

A Benchmark for Entropy Estimators. [PDF]

open access: yesEntropy (Basel)
Calcagnile LM, Di Garbo A, Galatolo S.
europepmc   +1 more source

A Fast Method for Selecting Bio Sourced Materials of Interest in a Candle Formulation

open access: yesJournal of the American Oil Chemists' Society, EarlyView.
ABSTRACT As consumer demand shifts towards more sustainable and nontoxic alternatives, the candle industry is exploring unconventional bio‐based and recycled materials as substitutes for paraffin. Four raw materials, that is rice bran wax (RBW), sugarcane wax (SCW), hydrogenated rapeseed oil (HRO), and waste cooking oil (WCO) were assessed based on ...
Salma Daoufa   +4 more
wiley   +1 more source

Optimization and Characterization of Aspirin‐ and Ibuprofen‐Loaded Lipid‐Based Nanoparticle Synthesis for Antibacterial Activity and Cytotoxic Effect

open access: yesAsia-Pacific Journal of Chemical Engineering, EarlyView.
ABSTRACT Lipid‐based nanoparticles (LNPs) are favored for drug delivery because of their low toxicity, high biocompatibility, ability to self‐assemble into nanoparticles, and ability to enhance drug bioavailability, thereby improving drug release modulation and pharmacokinetics.
Gulizar Caliskan   +3 more
wiley   +1 more source

Humidity‐Corrected Thermodynamic Modeling of Ammonium Chloride Crystallization Temperature Mechanisms and Application

open access: yesAsia-Pacific Journal of Chemical Engineering, EarlyView.
ABSTRACT As refineries process increasingly inferior crude oils, ammonium salt corrosion has intensified. Accurate prediction of ammonium salt crystallization temperatures and their influencing factors is therefore crucial for safe and stable operations.
Haozhe Jin   +7 more
wiley   +1 more source

Legendre polynomial transformation and energy-weighted random forests for sequential data classification. [PDF]

open access: yesSci Rep
Olaniran OR   +5 more
europepmc   +1 more source

Short‐Term Scheduling Optimization of a Single‐Pipeline Refining System With High Melting Point Crude Oil

open access: yesAsia-Pacific Journal of Chemical Engineering, EarlyView.
ABSTRACT In order to reflect the actual production situation more comprehensively and optimize the production cost, this paper solves the short‐term scheduling optimization problem for a single pipeline containing high melting point crude oil. Based on the refining plan given by the upper layer, a multi‐objective optimization model with high melting ...
Jing Yao   +5 more
wiley   +1 more source

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