Physical chemistry chemical physics : PCCP
Jul 30, 2025
Acetaminophen ranks among the most widely used pharmaceutical and personal care products today. Following consumption, the drug and its metabolites are excreted into sewage systems, wastewater treatment plants, and various aquatic environments, leadi...
This study investigated the impact of alkaline pretreatment on the biomethane yield of Xyris capensis experimentally and computationally using machine-learning (ML)-based techniques. Despite extensive studies on the anaerobic digestion of lignocellul...
International journal of biological macromolecules
Apr 30, 2025
Deep eutectic solvents (DESs) are gaining attention for lignocellulose pretreatment, yet screening methods and stable cyclic processes remain underexplored. This study compared solubility and machine learning to predict delignification, screening the...
International journal of biological macromolecules
Mar 3, 2025
Wood and its derivatives play a decisive role in traditional Chinese architecture. Waste wood as a major source of garbage in the construction industry represents a valuable source. The efficient recycling of waste wood has become an urgent technical...
International journal of biological macromolecules
Mar 2, 2025
The increasing demand for sustainable and eco-friendly materials has spurred significant interest in natural fibers as alternatives to synthetic reinforcements in composite applications. This study aims to explore the potential of Lablab purpureus fi...
The fourth industrial revolution will heavily rely on machine learning (ML). The rationale is that these strategies make various business operations in many sectors easier. ML modeling is the discovery of hidden patterns between multiple process para...
International journal of biological macromolecules
Sep 28, 2024
Lignin has been recognized as a major factor contributing to lignocellulosic recalcitrance in biofuel production and attracted attentions as a high-value product in the biorefinery field. As the traditional wet chemical methods for detecting lignin c...
Chemical pretreatment is a common method to enhance the cumulative methane yield (CMY) of lignocellulosic waste (LW) but its effectiveness is subject to various factors, and accurate estimation of methane production of pretreated LW remains a challen...
Physical eutectogels as a newly emerging type of conductive gel have gained extensive interest for the next generation multifunctional electronic devices. Nevertheless, some obstacles, including weak mechanical performance, low self-adhesive strength...
Physical chemistry chemical physics : PCCP
Jun 26, 2024
Using machine learning, molecular dynamics simulations, and density functional theory calculations we gain insight into the selectivity patterns of substrate activation by the cytochromes P450. In nature, the reactions catalyzed by the P450s lead to ...
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