[go: up one dir, main page]
More Web Proxy on the site http://driver.im/
You seem to have javascript disabled. Please note that many of the page functionalities won't work as expected without javascript enabled.
 
 
Sign in to use this feature.

Years

Between: -

Subjects

remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline

Journals

remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline

Article Types

Countries / Regions

remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline
remove_circle_outline

Search Results (7,333)

Search Parameters:
Keywords = hydrocarbons

Order results
Result details
Results per page
Select all
Export citation of selected articles as:
30 pages, 1296 KiB  
Review
The Double-Edge Sword of Natural Phenanthrenes in the Landscape of Tumorigenesis
by Yan Liu, Ziwei Du, Chen Sheng, Guangshuai Zhang, Si Yan, Zhijun Zhang and Shuanglin Qin
Molecules 2025, 30(6), 1204; https://doi.org/10.3390/molecules30061204 - 7 Mar 2025
Viewed by 62
Abstract
Phenanthrenes, which are polycyclic aromatic hydrocarbons comprising three benzene rings, exhibit a diverse range of functions. These compounds are utilized in the synthesis of resins, plant growth hormones, reducing dyes, tannins and other products. Notably, phenanthrenes possess significant pharmacological properties, including anti-tumor, anti-inflammatory [...] Read more.
Phenanthrenes, which are polycyclic aromatic hydrocarbons comprising three benzene rings, exhibit a diverse range of functions. These compounds are utilized in the synthesis of resins, plant growth hormones, reducing dyes, tannins and other products. Notably, phenanthrenes possess significant pharmacological properties, including anti-tumor, anti-inflammatory and antioxidant activities, offering broad prospects for development, particularly in the fields of medicine and health. Interestingly, although aristolochic acid (AA) is a potent carcinogen, its lactam analogs can kill cancer cells and exhibit therapeutic effects against cancer. This provides a promising strategy for the toxicity-effect transformation of phenanthrenes. In this paper, we reviewed 137 articles to systematically review the anti-tumor potential and toxic effects of natural phenanthrenes isolated from the 19th century to the present, thus offering references and laying a foundation for their further research, development and utilization. Full article
(This article belongs to the Special Issue Natural Bioactive Compounds from Traditional Asian Plants)
16 pages, 5239 KiB  
Article
The Distribution Characteristics and Genesis Analysis of Overpressure in the Qiongzhusi Formation in the Zizhong Area, Sichuan Basin
by Xuewen Shi, Yuran Yang, Qiuzi Wu, Yanyou Li, Yifan He, He Tian, Zhenxue Jiang, Zhongyu Bi and Huan Miao
Appl. Sci. 2025, 15(6), 2888; https://doi.org/10.3390/app15062888 - 7 Mar 2025
Viewed by 115
Abstract
Accurately predicting the genesis and distribution of reservoir pressure is essential for comprehending the distribution of oil and gas reservoirs while mitigating drilling risks. In the Qiongzhusi Formation of the Sichuan Basin, overpressure has developed, leading to high production levels in several wells. [...] Read more.
Accurately predicting the genesis and distribution of reservoir pressure is essential for comprehending the distribution of oil and gas reservoirs while mitigating drilling risks. In the Qiongzhusi Formation of the Sichuan Basin, overpressure has developed, leading to high production levels in several wells. However, the distribution and causal mechanism of overpressure within the Qiongzhusi Formation remain unclear at present. This study utilizes logging data from representative drilling wells to identify the causes of overpressure in the Qiongzhusi Formation and predict the characteristics of pressure distribution. The results indicate that the pressure coefficient of the Qiongzhusi Formation ranges from 1.01 to 2.05 and increases with burial depth. The overpressure in the Qiongzhusi Formation is attributed to fluid expansion, disequilibrium compaction, and pressure transmission. The contribution of disequilibrium compaction to pressure is 9.44 MPa, while hydrocarbon generation from organic matter contributes 82.66 MPa, and pressure transmission contributes 37.98 MPa. Additionally, the uplift erosion unloading effect and geothermal decline result in pressure reductions of approximately 26.68 MPa and 56.56 MPa, respectively. This study systematically elucidates the causes and distribution of overpressure in the Qiongzhusi Formation, providing valuable insights for subsequent exploration and development of shale gas in this formation. Full article
(This article belongs to the Section Energy Science and Technology)
Show Figures

Figure 1

Figure 1
<p>Geological background of the research area: (<b>a</b>) Geographical location of Sichuan Basin; (<b>b</b>) Geographical location of Zizhong area; (<b>c</b>) Contour map of mudstone thickness in Qiongzhusi Formation in Zizhong area; (<b>d</b>) Stratigraphic chart of Qiongzhusi Formation (modified after [<a href="#B18-applsci-15-02888" class="html-bibr">18</a>,<a href="#B19-applsci-15-02888" class="html-bibr">19</a>]).</p>
Full article ">Figure 2
<p>Characteristics of Pressure in the Qiongzhusi Formation: (<b>a</b>) Pressure vs. depth; (<b>b</b>) Pressure coefficient vs. depth.</p>
Full article ">Figure 3
<p>Typical drilling pressure prediction results of the Qiongzhusi Formation: (<b>a</b>) Z201; (<b>b</b>) GS17; (<b>c</b>) W207; (<b>d</b>) MX9.</p>
Full article ">Figure 4
<p>The prediction results of pressure in Qiongzhusi Formation: (<b>a</b>) plane distribution of pressure coefficient; (<b>b</b>) A–A’ pressure coefficient profile.</p>
Full article ">Figure 5
<p>Overpressure identification chart and overpressure cause identification of Qiongzhusi Formation: (<b>a</b>) resistivity–density plate; (<b>b</b>) sonic velocity–density plate; (<b>c</b>,<b>d</b>) overpressure cause identification of Z201; (<b>e</b>,<b>f</b>) overpressure cause identification of GS17; (<b>g</b>,<b>h</b>) overpressure cause identification of WY1H.</p>
Full article ">Figure 6
<p>Plate of Bowers method and overpressure cause identification of Qiongzhusi Formation: (<b>a</b>,<b>b</b>) Plate of Bowers method; (<b>c</b>,<b>d</b>) overpressure cause identification of Z201; (<b>e</b>,<b>f</b>) overpressure cause identification of GS17; (<b>g</b>,<b>h</b>) overpressure cause identification of WY1H.</p>
Full article ">Figure 7
<p>The contribution of different causes of overpressure to the pressure of the Qiongzhusi Formation: (<b>a</b>) disequilibrium compaction; (<b>b</b>) pressure transmission; (<b>c</b>) uplift erosion unloading effect; (<b>d</b>) geothermal decline.</p>
Full article ">
33 pages, 3673 KiB  
Review
Addressing Challenges for Eco-Friendly and Sustainable Wastewater Treatment Solutions Using Extremophile Microorganisms
by Hassan Mohamad Anabtawi, Amir Ikhlaq, Sandeep Kumar, Safa Rafique and Ashraf Aly Hassan
Sustainability 2025, 17(6), 2339; https://doi.org/10.3390/su17062339 - 7 Mar 2025
Viewed by 250
Abstract
The pressure on the environment from wastewater has been increasing in line with industrialization and urbanization, thus calling for better and eco-friendly solutions for wastewater treatment. Extremophilic microorganisms, which can grow in extreme conditions including high salinity, acidity, and temperature, can be applied [...] Read more.
The pressure on the environment from wastewater has been increasing in line with industrialization and urbanization, thus calling for better and eco-friendly solutions for wastewater treatment. Extremophilic microorganisms, which can grow in extreme conditions including high salinity, acidity, and temperature, can be applied in wastewater bioremediation. This review assesses the various functions of extremophiles, halophiles, thermophiles, alkaliphiles, and acidophiles in the treatment of organic and inorganic pollutants. They are capable of catabolizing a wide range of hazardous chemicals, such as polycyclic aromatic hydrocarbons, phenolic compounds, and heavy metals. Moreover, extremophilic microalgae, like Galdieria sulphuraria, have been effective in nutrient removal, biosorption of heavy metals, and pollutant conversion into valuable biomass. This dual-functioning, therefore, helps not only in wastewater treatment but also in the production of biofuel and biofertilizer, making the process cost-effective. The use of extremophiles in biofilm reactors improves pollutant removal, with less energy input. Extremophilic microorganisms can, therefore, be used to revolutionize wastewater management by providing green solutions to current treatment approaches. This review discusses the existing drawbacks of wastewater treatment along with the additional requirements needed to enhance the capability of bioremediation and potential future research. Full article
(This article belongs to the Special Issue Water Treatment, Waste Valorization and Environment Sustainability)
Show Figures

Figure 1

Figure 1
<p>Keyword Co-occurrence Network Map for Extremophilic Wastewater Treatment and Similar Research.</p>
Full article ">Figure 2
<p>Top 10 academic institutions by number of relevant research articles.</p>
Full article ">Figure 3
<p>Map illustrating the global distribution of scientific production.</p>
Full article ">Figure 4
<p>Line chart of the most cited countries for scientific research.</p>
Full article ">Figure 5
<p>Line graph showing related author’s publishing distribution by nation.</p>
Full article ">Figure 6
<p>Line graph illustrating the rise in scientific article output per nation over time.</p>
Full article ">Figure 7
<p>Adaptation mechanism of acidophilic substances for survival at acidic pH.</p>
Full article ">Figure 8
<p>Alkaliphiles’ role in wastewater treatment.</p>
Full article ">Figure 9
<p>Halophilic mechanisms in saline environment.</p>
Full article ">Figure 10
<p>Use of extremophilic microalgae in wastewater treatment.</p>
Full article ">
21 pages, 7184 KiB  
Article
Susceptibility and Remanent Magnetization Estimates from Orientation Tools in Borehole Imaging Logs
by Julio Cesar S. O. Lyrio, Ana Patrícia C. C. Laier, Jorge Campos Junior, Ana Natalia G. Rodrigues and Luciano dos Santos Martins
Appl. Sci. 2025, 15(5), 2873; https://doi.org/10.3390/app15052873 - 6 Mar 2025
Viewed by 157
Abstract
Orientation tools in borehole imaging logs acquire magnetic information that is currently used for spatial and geographical orientation of the images. We propose to use this magnetic field information to estimate both magnetic susceptibility and remanent magnetization of rocks inside wells. Measurements of [...] Read more.
Orientation tools in borehole imaging logs acquire magnetic information that is currently used for spatial and geographical orientation of the images. We propose to use this magnetic field information to estimate both magnetic susceptibility and remanent magnetization of rocks inside wells. Measurements of these magnetic parameters are not often available in hydrocarbon exploration to support forward modeling of magnetic data, an interpretation tool that has played important role in the exploration risk reduction in the Pre-Salt prospects of Campos Basin, Brazil. The acquired magnetic data requires corrections for tool rotation and diurnal variation of the Earth’s magnetic field before calculation. Then, using a set of simple equations and reasonable assumptions we were able to estimate the magnetic susceptibility of carbonates and basalts, as well as the remanent magnetization of the basalts, from a Pre-Salt well in Campos Basin. When compared to susceptibility values measured in laboratory for the same rock interval, our results show a significant match. This promising result shows the importance of our methodology in providing reliable information that can minimize uncertainties in forward modeling of magnetic data, which contributes to reduction of hydrocarbon exploration risks. Given that direct susceptibility and remanence measurements require oriented samples, a complex and expensive operation in wells, our results offer this rock information without any extra costs since imaging logs are commonly acquired in exploration wells. Besides its use in hydrocarbon exploration, our methodology can be applied to mineral exploration where magnetic susceptibility is an important property for rock identification. Full article
(This article belongs to the Special Issue Advances in Geophysical Exploration)
Show Figures

Figure 1

Figure 1
<p>Forward modeling example of Brazilian Pre-Salt exploration. The upper panels show the magnetic profiles. The models are shown in the lower panels where the blue regions are the non-magnetic rocks while the pink regions represent the igneous rocks. The green lines are the interface between layers as interpreted from seismic data. (<b>a</b>) The initial model with a thicker igneous package. (<b>b</b>) The final model suggesting less igneous rocks, which was confirmed by drilling (modified from [<a href="#B2-applsci-15-02873" class="html-bibr">2</a>]).</p>
Full article ">Figure 2
<p>Graphic illustration of some important definitions. (<b>a</b>) Spatial relationship between the components, <math display="inline"><semantics> <msub> <mi>F</mi> <mi>x</mi> </msub> </semantics></math>, <math display="inline"><semantics> <msub> <mi>F</mi> <mi>y</mi> </msub> </semantics></math> and <math display="inline"><semantics> <msub> <mi>F</mi> <mi>z</mi> </msub> </semantics></math>, of the magnetic field described in terms of three parameters: magnitude <span class="html-italic">F</span>, inclination <span class="html-italic">I</span> and declination <span class="html-italic">D</span>. The sign convention for field and its components is: x positive to north, y positive to east and z positive downward. (<b>b</b>) Representation of the meaning of four tool angles, SDEV, HAZI, RB and P1NO, which describes tool’s orientation in the geographical coordinate system (modified from [<a href="#B20-applsci-15-02873" class="html-bibr">20</a>]).</p>
Full article ">Figure 3
<p>Example of the amplitude fluctuation caused by tool’s rotation in a typical well. The strong amplitude fluctuations occurring in the horizontal components shown in (<b>a</b>) were greatly reduced after correction, as exhibit in (<b>b</b>).</p>
Full article ">Figure 4
<p>Geographic location of well 1-RJS-755-RJ at 2950 m water depth in the Campos Basin, Brazil. Contour lines represent the bathymetry (modified from [<a href="#B22-applsci-15-02873" class="html-bibr">22</a>]).</p>
Full article ">Figure 5
<p>Schematic dip-oriented geological section in the Campos showing the tectonostratigraphic mega-sequences (modified from [<a href="#B23-applsci-15-02873" class="html-bibr">23</a>]).</p>
Full article ">Figure 6
<p>Structural section through central Campos Basin showing the dominant detached structural style (modified from [<a href="#B24-applsci-15-02873" class="html-bibr">24</a>]).</p>
Full article ">Figure 7
<p>Simplified stratigraphic and tectonic framework of Campos Basin. (<b>a</b>) The main unconformities are: BSU (Base-Salt Unconformity), PRU (Post-Rift Unconformity), tRift (top Rift), tI/A (top Itabapoana/Atafona fms.), tBas (top basement), modified from [<a href="#B28-applsci-15-02873" class="html-bibr">28</a>]. (<b>b</b>) Geomagnetic polarity time scale for Cretaceous, modified from Concise Geologic Time Scale [<a href="#B29-applsci-15-02873" class="html-bibr">29</a>].</p>
Full article ">Figure 8
<p>The MFK1-FA instrument used to measure the magnetic susceptibility in 58 core samples collected in well 1-RJS-755-RJ (<a href="https://www.agico.cz/text/products/olddev/olddev.php" target="_blank">https://www.agico.cz/text/products/olddev/olddev.php</a>, (accessed on 31 January 2025)).</p>
Full article ">Figure 9
<p>Magnetic field and its components as acquired in well 1-RJS-755-RJ before (<b>a</b>) and after amplitude correction (<b>b</b>). Notice the significant change in the magnitude of the horizontal components after correction of the disturbance caused by tool rotation. The lithologic log is included for illustration.</p>
Full article ">Figure 10
<p>Diurnal variation of Earth’s magnetic field and its components on 10 February 2021 according to Vassouras Magnetic Observatory (VSS) in Rio de Janeiro, Brazil. The logging operation was from 02:26 to 7:58 AM, a period of relatively small variations.</p>
Full article ">Figure 11
<p>Measured magnetic field <span class="html-italic">F</span> after corrections. The field components were omitted to allow better visualization of the variation caused by the presence of igneous rocks. The lithologic log is included for illustration.</p>
Full article ">Figure 12
<p>(<b>a</b>) The Earth’s magnetic field in depth at position of well 1-RJS-755-RJ according to the EMM2017 model. (<b>b</b>) Differences in depth between the field measured in well 1-RJS-755-RJ and Earth’s magnetic field model. These small differences in amplitude are caused by the local geologic variation in depth. The lithologic log is included for illustration.</p>
Full article ">Figure 13
<p>Ranges and mean values of the magnetic susceptibility of the most common rock types (modified from [<a href="#B31-applsci-15-02873" class="html-bibr">31</a>]). For comparison, susceptibility estimates from our methodology are plotted as yellow circles (igneous rocks) and red circle (carbonates).</p>
Full article ">Figure 14
<p>Magnetic susceptibility estimates for well 1-RJS-755-RJ and the result of 58 susceptibility laboratory measurements made in rock samples. The lithologic log along the well is exhibited in the base of the chart for illustration.</p>
Full article ">
18 pages, 7968 KiB  
Article
Stages and Evolution of Strike-Slip Faults of the Ultra-Deep-Burial Ordovician Strata in Fuman Oilfield, Tarim Basin: Evidence from U-Pb Geochronology of Siliceous Minerals
by Chao Yao, Zhanfeng Qiao, Xiao Luo, Tianfu Zhang, Bing Li, Shaoying Chang, Zhenyu Zhang and Jiajun Chen
Minerals 2025, 15(3), 270; https://doi.org/10.3390/min15030270 - 6 Mar 2025
Viewed by 212
Abstract
Siliceous minerals with the property of resistance to diagenetic alteration precipitate during the migration of hydrothermal fluids through strike-slip faults and the interaction of these fluids with host rocks during fault activity. Based on petrological analyses and U-Pb dating of siliceous minerals, the [...] Read more.
Siliceous minerals with the property of resistance to diagenetic alteration precipitate during the migration of hydrothermal fluids through strike-slip faults and the interaction of these fluids with host rocks during fault activity. Based on petrological analyses and U-Pb dating of siliceous minerals, the stages of strike-slip faulting of the ultra-deep-burial Ordovician in the Fuman oilfield were subdivided and their evolutionary process was discussed in combination with seismic interpretation. The results reveal the following: (1) the strike-slip faults contain hydrothermal siliceous minerals, including cryptocrystalline silica, crystalline silica, and radial silica. (2) Based on the twelve U-Pb ages of siliceous minerals (ranging from 458 ± 78 Ma to 174 ± 35 Ma) and five U-Pb ages of calcite, the activity of the strike-slip faults was divided into six stages: the Middle Caledonian, Late Caledonian, Early Hercynian, Middle Hercynian, Late Hercynian, and Yanshanian, corresponding to twelve siliceous U-Pb ages ranging from 458 ± 78 Ma to 174 ± 35 Ma, and five calcitic U-Pb ages. The Late Caledonian and Early Hercynian were the main periods of strike-slip fault activity, while the Late Hercynian period marked the final period of the fault system. (3) Later-stage faults inherited and developed from pre-existing faults. Steep linear strike-slip faults formed during the Middle and Late Caledonian movements. During the Late Hercynian and Yanshanian movements, mid-shallow faults, branch faults, and shallow echelon faults developed on the foundation of these linear faults. The methods and results of this study can guide future hydrocarbon exploration in the Fuman oilfield and can be applied to areas with similar tectonic backgrounds. Full article
(This article belongs to the Special Issue Deformation, Diagenesis, and Reservoir in Fault Damage Zone)
Show Figures

Figure 1

Figure 1
<p>Distribution of the Ordovician strike-slip faults and drilled samples (<b>a</b>), locations of the Fuman oilfield and YAB outcrop (<b>b</b>), location of the Tarim basin (<b>c</b>), and lithological column (<b>d</b>). F<sub>I</sub> and F<sub>II</sub> mentioned in <a href="#minerals-15-00270-f001" class="html-fig">Figure 1</a>a indicate first-order faults and second-order faults, respectively.</p>
Full article ">Figure 2
<p>Photo of experimental core samples: (<b>a</b>) GL1, (<b>b</b>) GL2, (<b>c</b>) GL3, (<b>d</b>) GL3-H, (<b>e</b>) YM5, (<b>f</b>) YM6, (<b>g</b>) YM703, (<b>h</b>) MS5, and (<b>i</b>) MS711. Siliceous minerals occurred in fractures with three colors including dark gray (<b>a</b>–<b>e</b>), grayish white (<b>f</b>–<b>i</b>), and colorless (<b>c</b>–<b>e</b>).</p>
Full article ">Figure 3
<p>Optical microscope images under plane-polarized light of samples, except for c with cross-polarized light. (<b>a</b>) GL1, grain limestone with grains replaced by cryptocrystalline silica and cemented by microcrystalline silica. (<b>b</b>) GL2, same description as (<b>a</b>). (<b>c</b>) GL3, same description as (<b>a</b>) except for the radial silica filling in the center of siliceous component. (<b>d</b>–<b>f</b>) GL3-H, two stages of siliceous minerals with cryptocrystalline silica on the outside and radial silica at the core. (<b>g</b>) YM5, cryptocrystalline silica replacing grains and becoming cloudy, and chemically homogeneous radial silica. (<b>h</b>) YM6, silica replacing grains along fracture. (<b>i</b>) YM703, cryptocrystalline silica replacing grains and crystalline silica filling in the fractures. Silica cut by late fractures filled with sparry calcite. (<b>j</b>–<b>k</b>) MS5, bioclastic grain and matrix replaced by cryptocrystalline silica, intergranular and dissolved pores filled by crystalline silica, and residual calcite located inside and at the edges of the bioclastic grain. (<b>l</b>) MS711, same description as (<b>a</b>). Red dots in the figure represent siliceous U–Pb dating targets, while blue dots represent calcareous U–Pb dating targets.</p>
Full article ">Figure 4
<p>BSE images and chemical analysis points of the siliceous minerals for GL3 (<b>a</b>,<b>b</b>), GL3-H (<b>c</b>–<b>e</b>), and YM5 (<b>f</b>). Red dots correspond to the points in <a href="#minerals-15-00270-t002" class="html-table">Table 2</a>. Black represents fracture or pores, dark gray represents silica, grayish white represents calcite, and white represents pyrite. The picture in the lower-left corners of (<b>a</b>,<b>c</b>,<b>d</b>,<b>f</b>) is the energy spectrum. Square points in (<b>b</b>) are the laser ablation points for U–Pb dating.</p>
Full article ">Figure 5
<p>Comparison of δ<sup>30</sup>Si of experimental samples with different geological reservoirs (Revised from Wang et al. [<a href="#B43-minerals-15-00270" class="html-bibr">43</a>]; Zhang et al. [<a href="#B44-minerals-15-00270" class="html-bibr">44</a>]; Deng et al. [<a href="#B45-minerals-15-00270" class="html-bibr">45</a>]; and Savage et al. [<a href="#B46-minerals-15-00270" class="html-bibr">46</a>,<a href="#B47-minerals-15-00270" class="html-bibr">47</a>]).</p>
Full article ">Figure 6
<p>U–Pb dating results of silica (red) and calcite (blue) in sampled fractures by LA-MC-ICP-MS. (<b>a</b>–<b>k</b>) Silica U–Pb dating of GL1, GL2, GL3, GL3-H (cryptocrystalline silica), GL3-H (radial silica), YM5, YM6, YM703, MS5 (cryptocrystalline silica of bioclast), MS5 (cryptocrystalline silica of matrix), and MS711, respectively; (<b>l</b>–<b>p</b>) Calcite U–Pb dating of GL2, GL3-H, YM703, MS5, and MS711; more details shown in <a href="#minerals-15-00270-t001" class="html-table">Table 1</a> and <a href="#minerals-15-00270-f003" class="html-fig">Figure 3</a>.</p>
Full article ">Figure 7
<p>The petrological characteristics and U–Pb age of siliceous rocks in the siliceous streak, 20 cm away from diabase intrusion of the Penglaiba Formation in the Yong’anba outcrop. (<b>a</b>) Outcrop photo; (<b>b</b>) sample photo of YAB; (<b>c</b>) optical microscope photo of YAB; (<b>d</b>) U–Pb dating result of YAB.</p>
Full article ">Figure 8
<p>The developments of strike-slip faults in the Fuman oilfield based on U–Pb dating [<a href="#B31-minerals-15-00270" class="html-bibr">31</a>,<a href="#B51-minerals-15-00270" class="html-bibr">51</a>].</p>
Full article ">Figure 9
<p>Seismic profiles and strike-slip fault interpretation of GL3-H well in F<sub>I</sub>5 (<b>a</b>), YM5 well in F<sub>I</sub>7 (<b>b</b>), and MS5 well in F<sub>I</sub>17 (<b>c</b>).</p>
Full article ">Figure 10
<p>Seismic profile (<b>a</b>) and evolution process at different periods (<b>b</b>–<b>f</b>) of F<sub>I</sub>17.</p>
Full article ">
22 pages, 21431 KiB  
Article
Investigation of Flow Characteristics in Rotating Distributary and Confluence Cavities
by Kuan Zheng, Huan Ma, Hongchuang Sun and Jiang Qin
Energies 2025, 18(5), 1287; https://doi.org/10.3390/en18051287 - 6 Mar 2025
Viewed by 85
Abstract
Power generation is an important part of air vehicle energy management when developing long-endurance and reusable hypersonic aircraft. In order to utilize an air turbine power generation system on board, fuel-based rotating cooling has been researched to cool the turbine’s rotor blades. For [...] Read more.
Power generation is an important part of air vehicle energy management when developing long-endurance and reusable hypersonic aircraft. In order to utilize an air turbine power generation system on board, fuel-based rotating cooling has been researched to cool the turbine’s rotor blades. For fuel-cooling air turbines, each blade corresponds to a separate cooling channel. All the separate cooling channels cross together and form a distributary cavity and a confluence cavity in the center of the disk. In order to determine the flow characteristics in the distributary and confluence cavities, computational fluid dynamics (CFD) simulations using the shear–stress–transport turbulence model were carried out under the conditions of different rotating speeds and different mass flow rates. The results showed great differences between non-rotating flow and rotating flow conditions in the distributary and confluence cavities. The flow in the distributary and confluence cavities has rotational velocity, with obvious layering distribution regularity. Moreover, a high-speed rotational flow surface is formed in the confluence cavity of the original structure, due to the combined functions of centrifugal force, inertia, and the Coriolis force. Great pressure loss occurs when fluid passes through the high-speed rotational flow surface. This pressure loss increases with the increase in rotating speed and mass flow rate. Finally, four structures were compared, and an optimal structure with a separated outlet channel was identified as the best structure to eliminate this great pressure loss. Full article
(This article belongs to the Section F: Electrical Engineering)
Show Figures

Figure 1

Figure 1
<p>Geometry model and mesh.</p>
Full article ">Figure 2
<p>Summary of the studied channels.</p>
Full article ">Figure 3
<p>CFD validation for the turbulence model.</p>
Full article ">Figure 4
<p>Velocity distributions and streamlines in the distributary cavity under nonrotating and rotating conditions.</p>
Full article ">Figure 5
<p>Velocity vector of the distributary cavity under nonrotating and rotating conditions.</p>
Full article ">Figure 6
<p>Total pressure distribution of the distributary cavity under nonrotating and rotating conditions.</p>
Full article ">Figure 7
<p>Velocity distribution and streamlines of the confluence cavity under nonrotating and rotating conditions.</p>
Full article ">Figure 8
<p>Velocity vector of the confluence cavity under nonrotating and rotating conditions.</p>
Full article ">Figure 9
<p>Total pressure distribution of the confluence cavity under nonrotating and rotating conditions.</p>
Full article ">Figure 10
<p>Static pressure distribution along a radial direction in the centrifugal and centripetal channels under rotating conditions.</p>
Full article ">Figure 11
<p>Variations in vortex from the centrifugal channel to the centripetal channel.</p>
Full article ">Figure 12
<p>Pressure difference between the inlet and outlet of the rotating channel.</p>
Full article ">Figure 13
<p>Four outlet structures (The arrows indicate the flow direction).</p>
Full article ">Figure 14
<p>Pressure distributions along the radial direction in the centripetal channel for different outlet structures.</p>
Full article ">
21 pages, 2664 KiB  
Review
Review on Changes in Shale Oil Property During CO2 Injection
by Xiang Li, Songtao Wu, Yue Shen and Chanfei Wang
Energies 2025, 18(5), 1264; https://doi.org/10.3390/en18051264 - 4 Mar 2025
Viewed by 156
Abstract
The influence of supercritical CO2 on the properties of petroleum has become the focus of academic and industrial attention internationally. CO2 has been shown in laboratory studies and in field applications of shale oil to be an effective oil displacement agent. [...] Read more.
The influence of supercritical CO2 on the properties of petroleum has become the focus of academic and industrial attention internationally. CO2 has been shown in laboratory studies and in field applications of shale oil to be an effective oil displacement agent. In this paper, the research progress of the interaction between CO2 and crude oil is investigated from three perspectives: (i) the research methods of the interaction experiment between CO2 and crude oil; (ii) the influence of CO2 on oil property and the primary controlling factors; and (iii) the cause, influence, and harm of CO2-induced asphaltene precipitation. Our current knowledge on this topic is as follows: (1) Physical simulation can investigate the effects of various variables on CO2 displacement, which is in situ and intuitive. Numerical simulation can investigate the displacement principle at the microscopic molecular level and also scale up the results of physical simulation to the macroscopic scale of oilfield production to explore the long-term large-scale injection rules; (2) after entering the formation, CO2 dissolves in crude oil, expands the volume of crude oil, reduces the viscosity, improves the oil–water mobility ratio, reduces the oil–water interfacial tension, and extracts light hydrocarbons to form a miscible displacement zone; (3) after CO2 is injected into the formation and dissolves in crude oil, it occupies the surface space of asphaltenes and causes asphaltenes to precipitate. Under the combined influence of internal and external factors, the precipitation of asphaltenes has a significant impact on the physical properties of the reservoir. Clarifying the influencing factors of CO2 on the property of crude oil has reference significance for understanding the reaction characteristics between supercritical CO2 and formation fluids, providing a theoretical basis for CO2 injection enhanced oil recovery technology, and has reference value for carbon storage research. Full article
(This article belongs to the Section B2: Clean Energy)
Show Figures

Figure 1

Figure 1
<p>Microscopic experiment of CO<sub>2</sub> injection. (<b>a</b>) After water injection (20 MPa, 0.06 mL/min); (<b>b</b>) after CO<sub>2</sub> injection (30 MPa); (<b>c</b>) after CO<sub>2</sub> injection (40 MPa); (<b>d</b>) after CO<sub>2</sub> injection (50 MPa) [<a href="#B32-energies-18-01264" class="html-bibr">32</a>].</p>
Full article ">Figure 2
<p>Volume swelling coefficients of different alkanes [<a href="#B40-energies-18-01264" class="html-bibr">40</a>,<a href="#B64-energies-18-01264" class="html-bibr">64</a>,<a href="#B66-energies-18-01264" class="html-bibr">66</a>].</p>
Full article ">Figure 3
<p>Viscosity reduction ratio of different viscosity crude oil [<a href="#B75-energies-18-01264" class="html-bibr">75</a>,<a href="#B78-energies-18-01264" class="html-bibr">78</a>,<a href="#B79-energies-18-01264" class="html-bibr">79</a>,<a href="#B80-energies-18-01264" class="html-bibr">80</a>,<a href="#B81-energies-18-01264" class="html-bibr">81</a>].</p>
Full article ">Figure 4
<p>Trend of oil–water interfacial tension before and after the experiment [<a href="#B17-energies-18-01264" class="html-bibr">17</a>,<a href="#B40-energies-18-01264" class="html-bibr">40</a>,<a href="#B86-energies-18-01264" class="html-bibr">86</a>,<a href="#B87-energies-18-01264" class="html-bibr">87</a>,<a href="#B88-energies-18-01264" class="html-bibr">88</a>].</p>
Full article ">Figure 5
<p>Extracted oil composition distribution under different extraction pressures [<a href="#B60-energies-18-01264" class="html-bibr">60</a>,<a href="#B94-energies-18-01264" class="html-bibr">94</a>,<a href="#B98-energies-18-01264" class="html-bibr">98</a>,<a href="#B99-energies-18-01264" class="html-bibr">99</a>].</p>
Full article ">Figure 6
<p>Amount of asphaltene precipitation with temperature change [<a href="#B50-energies-18-01264" class="html-bibr">50</a>,<a href="#B117-energies-18-01264" class="html-bibr">117</a>,<a href="#B118-energies-18-01264" class="html-bibr">118</a>].</p>
Full article ">Figure 7
<p>Amount of asphaltene precipitation with pressure change [<a href="#B11-energies-18-01264" class="html-bibr">11</a>,<a href="#B50-energies-18-01264" class="html-bibr">50</a>,<a href="#B117-energies-18-01264" class="html-bibr">117</a>,<a href="#B121-energies-18-01264" class="html-bibr">121</a>].</p>
Full article ">Figure 8
<p>Trend of permeability before and after the experiment [<a href="#B134-energies-18-01264" class="html-bibr">134</a>,<a href="#B135-energies-18-01264" class="html-bibr">135</a>,<a href="#B136-energies-18-01264" class="html-bibr">136</a>,<a href="#B137-energies-18-01264" class="html-bibr">137</a>,<a href="#B138-energies-18-01264" class="html-bibr">138</a>,<a href="#B139-energies-18-01264" class="html-bibr">139</a>].</p>
Full article ">
18 pages, 1140 KiB  
Article
Effect of Schinus areira L. Essential Oil on Attraction, Reproductive Behavior, and Survival of Ceratitis capitata Wiedemann
by Flavia Jofré Barud, María Pía Gomez, María Josefina Ruiz, Guillermo Bachmann, Diego Fernando Segura, María Teresa Vera and María Liza López
Plants 2025, 14(5), 794; https://doi.org/10.3390/plants14050794 - 4 Mar 2025
Viewed by 241
Abstract
The essential oil (EO) of Schinus areira exhibits a chemical composition dominated by monoterpene and sesquiterpene hydrocarbons, with α-phellandrene, limonene, α-pinene, and p-cymene as major constituents. This study aimed to evaluate the effects of S. areira EO on the biology and behavior of [...] Read more.
The essential oil (EO) of Schinus areira exhibits a chemical composition dominated by monoterpene and sesquiterpene hydrocarbons, with α-phellandrene, limonene, α-pinene, and p-cymene as major constituents. This study aimed to evaluate the effects of S. areira EO on the biology and behavior of the Mediterranean fruit fly, Ceratitis capitata, particularly its attraction to the EO and the impact on its reproductive behavior and survival. Females were attracted at the initial choice and the time spent in the arm of the Y-tube olfactometer with the EO was longer, while males were attracted at the final choice, indicating the attractive potential of S. areira EO for both sexes of C. capitata. Within the context of the sterile insect technique (SIT), the better performance of released sterile males allows more copulations with wild females in competition with wild males, increasing the efficacy of the SIT. Exposure of tsl sterile males to the EO did not enhance their sexual competitiveness and increased latency to initiate copulation, indicating potential adverse effects. In addition, in oviposition assays, only a low concentration of the EO stimulated egg-laying on treated substrates, possibly due to the absence of deterrent compounds such as linalool. Finally, the LD50 of the EO was <25 µg/fly for both females and males, at 72 h post-treatment. These findings highlight the potential of EOs as biopesticides that influence the behaviors of C. capitata and emphasize the need for further studies to optimize their application in integrated pest management strategies, including the SIT. Full article
(This article belongs to the Special Issue Emerging Topics in Botanical Biopesticides—2nd Edition)
Show Figures

Figure 1

Figure 1
<p>Relative sterility index (RSI) of <span class="html-italic">tsl</span> sterile males of <span class="html-italic">Ceratitis capitata</span> exposed and non-exposed (control) to the essential oil of <span class="html-italic">Schinus areira</span>.</p>
Full article ">Figure 2
<p>Number of eggs laid by females of <span class="html-italic">Ceratitis capitata</span> on grapes under different concentration treatments of <span class="html-italic">Schinus areira</span> essential oil. Different letters indicate significant differences at <span class="html-italic">p</span> &lt; 0.05.</p>
Full article ">Figure 3
<p>Overview of the assays performed to evaluate the effects of <span class="html-italic">Schinus areira</span> EO on attraction, mating, oviposition, and survival of <span class="html-italic">Ceratitis capitata</span> adults.</p>
Full article ">
14 pages, 4947 KiB  
Article
Application of Textile Composite Materials as a Sorbent for Cleaning Up Oil Spills
by Daniela Angelova, Desislava Staneva, Daniela Atanasova and Vesislava Toteva
Materials 2025, 18(5), 1146; https://doi.org/10.3390/ma18051146 - 4 Mar 2025
Viewed by 162
Abstract
This article compares two new textile materials used to clean up spills of oil or two oil products (crude oil, diesel fuel, and base oil SN 150). The plain-woven cotton fabric is hydrophilic, with a typical porous structure. After coating with a layer [...] Read more.
This article compares two new textile materials used to clean up spills of oil or two oil products (crude oil, diesel fuel, and base oil SN 150). The plain-woven cotton fabric is hydrophilic, with a typical porous structure. After coating with a layer of chitosan modified with benzaldehyde and cross-linked with glutaraldehyde (CB), its hydrophobicity increases, hence the sorption affinity to hydrophobic hydrocarbons. Including in situ synthesized zinc oxide particles in the hydrophobic chitosan layer (CBZ) changes its structure and increases the sorption capacity. The morphology of the layers was assessed using scanning electron microscopy (SEM) and by comparing the contact angles of the pollutants against the cotton fabric and the composite materials. EDX analysis and mapping for the Zn element show that zinc is homogeneously distributed on the fabric surface. The roughness enhancement and mesoporous structure under the influence of zinc oxide particles were established by the Brunauer Emmett Teller (BET) method and atomic force microscopy (AFM). The advantages of textile composites are their flexibility, stability, and ability to float on the water and wipe up oil spills. It was found that the materials can be successfully regenerated and used repeatedly, making them highly effective because the sorbed crude oil or petroleum products can be separated and utilized. Full article
(This article belongs to the Section Polymeric Materials)
Show Figures

Graphical abstract

Graphical abstract
Full article ">Figure 1
<p>Schematic representation of the CB and CBZ sorbent materials’ preparation.</p>
Full article ">Figure 2
<p>SEM micrographs of (<b>A</b>) cotton fabric; (<b>B</b>) CB fabric; (<b>C</b>) CBZ fabric.</p>
Full article ">Figure 3
<p>EDX analysis, EDX mapping for Zn element distribution and SEM micrographs of CBZ (<b>A</b>) on the yarn surface and (<b>B</b>) in the void space between the yarns.</p>
Full article ">Figure 4
<p>SEM images at 10.00k× magnification and AFM 2D and 3D images of (<b>A</b>) cotton fibers; (<b>B</b>) CB fibers; (<b>C</b>) CBZ fibers.</p>
Full article ">Figure 5
<p>Nitrogen adsorption/desorption isotherms of the cotton fabric CO and CB and CBZ samples.</p>
Full article ">Figure 6
<p>Water sorption capacity of the cotton fabric CO and samples CB and CBZ.</p>
Full article ">Figure 7
<p>Sorption capacity of the CB and CBZ samples.</p>
Full article ">Figure 8
<p>Regenerability of CBZ material.</p>
Full article ">
17 pages, 5075 KiB  
Article
Insight into the Role of the Aryl Hydrocarbon Receptor in Bovine Coronavirus Infection by an Integrated Approach Combining In Vitro and In Silico Methods
by Luca Del Sorbo, Clementina Acconcia, Maria Michela Salvatore, Giovanna Fusco, Violetta Vasinioti, Maria Stella Lucente, Liqian Zhu, Annamaria Pratelli, Luigi Russo, Anna Andolfi, Rosa Iacovino and Filomena Fiorito
Microorganisms 2025, 13(3), 579; https://doi.org/10.3390/microorganisms13030579 - 4 Mar 2025
Viewed by 233
Abstract
It is well known that the host response to different human and animal coronaviruses infection is regulated by the aryl hydrocarbon receptor, a ligand-activated transcription factor. The present study investigates the expression of the aryl hydrocarbon receptor during bovine coronavirus infection, through in [...] Read more.
It is well known that the host response to different human and animal coronaviruses infection is regulated by the aryl hydrocarbon receptor, a ligand-activated transcription factor. The present study investigates the expression of the aryl hydrocarbon receptor during bovine coronavirus infection, through in vitro and in silico investigations. The in vitro studies demonstrate that the aryl hydrocarbon receptor and as well as its targets, CYP1A1 and CYP1B1, were significantly activated by bovine coronavirus infection in bovine cells (MDBK). During infection, the pretreatment of cells with non-cytotoxic doses of CH223191, a selective inhibitor of the aryl hydrocarbon receptor, resulted in a significant reduction in virus yield and a downregulation in the viral spike protein expression. These findings occurred in the presence of the inhibition of aryl hydrocarbon receptor signaling. Our results reveal that the bovine coronavirus acts on viral replication, upregulating the aryl hydrocarbon receptor and its downstream target proteins, CYP1A1 and CYP1B1. In addition, following the in silico studies, the three-dimensional structural model of the bovine aryl hydrocarbon receptor in complex with the antagonist CH223191 indicates that the molecular mechanism, by which the PASB and TAD domains of the receptor interact with the inhibitor, is mainly driven by an extensive network of hydrophobic interactions, with a series of hydrogen bonds contributing to stabilizing the complex. Interestingly, bioinformatic analyses revealed that the PASB and TAD domains in the human and bovine aryl hydrocarbon receptor present high similarity at the primary sequence and three-dimensional structure levels. Taken together, these findings represent a fundamental step for the development of innovative drugs targeting AhR as a potential object for CoVs therapy. Full article
(This article belongs to the Special Issue Viral Diseases: Current Research and Future Directions)
Show Figures

Graphical abstract

Graphical abstract
Full article ">Figure 1
<p>Chemical structure of the AhR inhibitor CH223191.</p>
Full article ">Figure 2
<p>The AhR inhibitor CH223191 at the concentration of 2 µM induces no significant (<span class="html-italic">p</span> &gt; 0.5) differences in MDBK cell viability after 24 h of pretreatment. (<b>A</b>) Microscopic MDBK cells treated with DMSO or with CH223191 at different concentrations and stained with TB while cells were attached to wells. Scale bar 100 µm. (<b>B</b>). Identification of the IC<sub>50</sub> of CH223191 inhibitor by using different concentrations (2, 5, 10, and 20 μM) and development of dose–response curve in MDBK cells after 24 h of pretreatment. Cell viability was assessed by TB staining and scored by an automated cell counter. Significant differences between DMSO and CH223191-treated cells are indicated by probability <span class="html-italic">p</span>. ** <span class="html-italic">p</span> &lt; 0.01 and *** <span class="html-italic">p</span> &lt; 0.001.</p>
Full article ">Figure 3
<p>AhR inhibitor CH223191 increases cell viability during BCoV infection. (<b>A</b>) MDBK cells pretreated or not with CH223191 at 2 µM and infected with BCoV. At 24 h p.i., cells were stained with TB while cells were attached to wells and observed under a light microscope. Scale bar = 100 µm. (<b>B</b>) Dose–response curve of MDBK cells pretreated with CH223191 at 2 μM and infected with BCoV. After 24 h of infection, cell viability was determined by TB staining and scored by automated cell counter. Significant differences between BCoV+DMSO and BCoV+CH223191-treated cells are indicated by probability <span class="html-italic">p</span>. *** <span class="html-italic">p</span> &lt; 0.001.</p>
Full article ">Figure 4
<p>AhR inhibitor CH223191 reduced morphological signs of cell death during BCoV infection in MDBK cells. Cells pretreated or not with CH223191 were infected with BCoV. At 24 h p.i., cells were stained with (<b>A</b>) Giemsa and analyzed under a light microscope. Morphological features of cell death, such as cellular shrinkage (arrowhead) and pyknosis and chromatin condensation (arrow) were mainly reduced in the CH223191-treated infected groups. (<b>B</b>) In AO/PI panels, PI fluorescent cells, indicating dead and/or dying cells, were mainly detected in BCoV-infected cells compared to CH213191-treated infected cells. Scale bar 100 µm. The results of one experiment representative of three independent experiments were reported.</p>
Full article ">Figure 5
<p>AhR inhibitor CH223191 induces a reduction in virus yield during BCoV infection in MDBK cells. Cells pretreated or not with AhR inhibitor CH223191 were infected with BCoV at 24 h p.i. (<b>A</b>) Virus yield was assessed by the TCID<sub>50</sub> method and reported as Log TCID<sub>50</sub>/mL. Significant differences between BCoV-infected cells and CH223191-treated infected cells are indicated by probability <span class="html-italic">p</span>. *** <span class="html-italic">p</span> &lt; 0.001. (<b>B</b>) CPE by crystal violet staining was detected by the ZOE Cell Imager. Scale bar 100 µm. The results of one experiment representative of three independent experiments were reported.</p>
Full article ">Figure 6
<p>AhR is expressed in MDBK cells. AhR inhibitor CH223191 significantly induced a reduction in AhR expression in MDBK cells. BCoV activates the expression of AhR, and the AhR inhibitor (CH223191) downregulates both AhR and S protein expression during BCoV infection in MDBK cells. (<b>A</b>) In CH223191-treated and untreated uninfected cells, as well as in CH223191-treated and untreated BCoV-infected cells, immunofluorescence staining was performed to assess AhR and S protein expression. Scale bar = 25 µm. (<b>B</b>,<b>C</b>) Bars are the mean ratio generated from the integrated density (product of area and mean fluorescence intensity) of the AhR and S protein expression during BCoV infection. Significant differences between control (DMSO-treated) and BCoV-infected cells, as well as between BCoV-infected cells and AhR-inhibitor-treated infected cells for both AhR and S proteins, are indicated by probability <span class="html-italic">p</span>. * <span class="html-italic">p</span> &lt; 0.05 and *** <span class="html-italic">p</span> &lt; 0.001. The integrated density was measured by ImageJ. Error bars represent standard deviation measurement. The results of one experiment representative of three independent experiments were reported.</p>
Full article ">Figure 7
<p>BCoV activates the expression of both CYP1A1 and CYP1B1 (AhR signaling) during infection in MDBK cells. MDBK cells, pretreated or not with AhR inhibitor, were infected with BCoV at an MOI of 0.5 for 24 h. Then, immunofluorescence staining with antibodies recognizing (<b>A</b>) CYP1A1 and (<b>B</b>) CYP1B1 was performed. Scale bar = 50 µm. (<b>C</b>,<b>D</b>) Bars are the mean ratio generated from the integrated density (product of the area and mean fluorescence intensity) of the CYP1A1 and CYP1B1 expression during BCoV infection. Significant differences between DMSO and BCoV-infected cells, as well as between BCoV-infected cells and AhR-inhibitor-treated infected cells for both CYP1A1 and CYP1B1 proteins, are indicated by probability <span class="html-italic">p</span>. * <span class="html-italic">p</span> &lt; 0.05 and <span class="html-italic">p</span>. ** <span class="html-italic">p</span> &lt; 0.01. The integrated density was measured by ImageJ. Error bars represent standard deviation measurement. The results of one experiment representative of three independent experiments were reported.</p>
Full article ">Figure 8
<p>Recognition mechanism of CH223191 at the bAhR. (<b>A</b>) Structural representation of the full-length b AhR r, highlighting its four key domains: the bHLH (basic Helix-Loop-Helix) domain, spanning residues 27–80; the PAS A (Per Arnt Sim A) domain, spanning residues 111–181; the PAS B (Per Arnt Sim B) domain, spanning residues 275–342; and the TAD (Transactivation Domain), spanning residues 348–386. Each domain plays a crucial role in the function of the receptor and ligand interaction, providing a detailed understanding of the structural organization of the receptor. (<b>B</b>) 3D model of the bAhR (residues 1–400) predicted by AlphaFold, showing the folded regions containing the bHLH, PAS A, and PAS B domains. (<b>C</b>) Docking model of the CH223191 ligand bound to the bAhR. The figure highlights two key hydrogen bonds formed with residues Gln382 and Ser345, a π–π interaction with the aromatic side chain of Phe294, and several hydrophobic interactions with surrounding residues of the receptor, all of which are illustrated in the figure. These interactions contribute to the stable binding of CH223191 within the ligand-binding domain of the receptor.</p>
Full article ">
23 pages, 3396 KiB  
Article
Subcritical Extraction of Coal Tar Slag and Analysis of Extracts and Raffinates
by Xiaohua Wang, Zhongchao Zhu and Jianyou Zhao
Appl. Sci. 2025, 15(5), 2694; https://doi.org/10.3390/app15052694 - 3 Mar 2025
Viewed by 317
Abstract
Coal is an important energy source for the development of modern society. The processing and utilization of coal have brought significant economic benefits for people, but at the same time, a large amount of coal-based solid waste is produced. Coal tar slag is [...] Read more.
Coal is an important energy source for the development of modern society. The processing and utilization of coal have brought significant economic benefits for people, but at the same time, a large amount of coal-based solid waste is produced. Coal tar slag is one of the many types of solid waste. Coal tar slag contains a large number of PAHs (Polycyclic Aromatic Hydrocarbons) that are carcinogenic to humans and are therefore categorized as hazardous waste. There is a large historical stockpile of coal tar slag, and if not properly handled, it will cause great harm to people and the environment; therefore, the disposal of coal tar slags is a hot issue for scholars to study. In this paper, the toxic PAHs in coal tar slag were removed by subcritical extraction, and the extracts and raffinates were tested using infrared spectroscopy, GC-MS (gas chromatography–mass spectrometry), and PY-GC-MS (Pyrolysis Gas Chromatography–Mass Spectrometry). The results showed that after three subcritical extractions at 60 °C, there were obvious aromatic hydrocarbon absorption peaks in the extracts, and the intensity of aromatic hydrocarbons in the extracts was significantly reduced. In the first extract, mainly aliphatic hydrocarbons and aromatic hydrocarbons dominated; the relative content of aliphatic hydrocarbons was 28.68%, and the relative content of aromatic hydrocarbons was 56.56%. In the second extract, mainly aliphatic hydrocarbons and ethers dominated; the relative content of aliphatic hydrocarbons was 37.11%, and the relative content of ethers was 18.5%. In the third extract, mainly aliphatic hydrocarbons dominated, and the relative content of aliphatic hydrocarbons was 81.78%. Only one substance, benzaldehyde, was detected in the PY-GC-MS results of the third extract, and this substance is not included in the national hazardous waste list. After subcritical extraction, the coal tar residue is transformed from coal-based hazardous waste to coal-based solid waste that can be used directly, which is convenient for people to recycle coal tar residue in the future. Full article
Show Figures

Figure 1

Figure 1
<p>Schematic diagram of subcritical extraction equipment.</p>
Full article ">Figure 2
<p>Flowchart of the experiment.</p>
Full article ">Figure 3
<p>Infrared spectral test chart of tarry slag raw sample.</p>
Full article ">Figure 4
<p>Total ion flow chromatogram of PY-GC-MS of coal tar slag raw sample.</p>
Full article ">Figure 5
<p>Infrared spectra of 3 subcritical extracts at 60 °C.</p>
Full article ">Figure 6
<p>Localized enlargement of infrared spectra of 3 extracts.</p>
Full article ">Figure 7
<p>Infrared spectra of subcritical raffinates extracted 3 times at 60 °C.</p>
Full article ">Figure 8
<p>Localized enlarged view of 3 raffinates.</p>
Full article ">Figure 9
<p>GC-MS total ion flow chromatogram of the first extract of coal tar slag.</p>
Full article ">Figure 10
<p>GC-MS total ion flow chromatogram of the second extract of coal tar slag.</p>
Full article ">Figure 11
<p>GC-MS total ion flow chromatogram of the third extract of coal tar slag.</p>
Full article ">Figure 12
<p>Total ion flow chromatogram of PY-GC-MS of the first raffinate of coal tar slag.</p>
Full article ">Figure 13
<p>Total ion flow chromatogram of PY-GC-MS of the second raffinate of coal tar slag.</p>
Full article ">Figure 14
<p>Total ion flow chromatogram of PY-GC-MS of the third extract of coal tar slag.</p>
Full article ">
18 pages, 4084 KiB  
Article
Investigating the Potential of Native Soil Bacteria for Diesel Biodegradation
by Mihaela Marilena Stancu
Microorganisms 2025, 13(3), 564; https://doi.org/10.3390/microorganisms13030564 - 2 Mar 2025
Viewed by 295
Abstract
In countries with a long petroleum extraction and processing history, such as Romania, extensive soil areas are often polluted with petroleum and its derivatives, posing significant environmental and human health risks. This study explores the diesel biodegradation potential of two native bacterial consortia [...] Read more.
In countries with a long petroleum extraction and processing history, such as Romania, extensive soil areas are often polluted with petroleum and its derivatives, posing significant environmental and human health risks. This study explores the diesel biodegradation potential of two native bacterial consortia isolated from hydrocarbon-polluted soils, focusing on their phenotypic and molecular characteristics, growth kinetics, alkane hydroxylase activity, hydrolase production, and biosurfactant synthesis capabilities. The bacterial consortia, CoP1 and CoP2, were successfully obtained using the standard successive enrichment culture method from two soil samples collected from a region affected by petroleum pollution. The CoP1 and CoP2 consortia demonstrated efficient diesel-degrading capabilities, achieving 50.81−84.32% degradation when cultured in a minimal medium containing 1–10% (v/v) diesel as the sole carbon and energy source. This biodegradation potential was corroborated by their significant alkane hydroxylase activity and the detection of multiple catabolic genes in their genomes. The CoP1 consortium contains at least four catabolic genes (alkB, alkM, todM, ndoM) as well as rhamnosyltransferase 1 genes (rhlAB), while the CoP2 consortium contains only two catabolic genes (ndoM, C23DO). The RND transporter gene (HAE1) was present in both consortia. Secondary metabolites, such as glycolipid-type biosurfactants, as well as extracellular hydrolases (protease, amylase, cellulase, and lipase), were produced by both consortia. The CoP1 and CoP2 consortia demonstrate exceptional efficiency in diesel degradation and biosurfactant production, making them well suited for the bioremediation of soils contaminated with petroleum and its derivatives. Full article
(This article belongs to the Section Microbial Biotechnology)
Show Figures

Figure 1

Figure 1
<p>Isolation of native bacterial consortia and their quantification. Soil samples P1 and P2 used to initiate enrichment cultures in MSM-petroleum 5%; bacteria quantification in enrichment cultures by most probable number (MPN) method (microplate before and after TTC addition) and plate count agar (PCA) method; isolated bacterial consortia (BCo) CoP1 and CoP2; Petri plates observed under visible and UV light.</p>
Full article ">Figure 2
<p>Biodegradation of diesel by native bacterial consortia. CoP1 cultured in MSM-diesel 1% (<span class="html-italic">1</span>), 5% (<span class="html-italic">2</span>), 10% (<span class="html-italic">3</span>); CoP2 cultured in MSM-diesel 1% (<span class="html-italic">4</span>), 5% (<span class="html-italic">5</span>), 10% (<span class="html-italic">6</span>); control (C, uninoculated medium). Cell viability (CV); pyocyanin (PcP) and pyoverdine (PvP) production; Rh6G accumulation; lactose fermentation (LF); Petri plates observed under visible and UV light.</p>
Full article ">Figure 3
<p>Enzymatic and protein profile of native bacterial consortia. CoP1 cultured in MSM-diesel 1% (<span class="html-italic">1</span>), 5% (<span class="html-italic">2</span>), 10% (<span class="html-italic">3</span>); CoP2 cultured in MSM-diesel 1% (<span class="html-italic">4</span>), 5% (<span class="html-italic">5</span>), 10% (<span class="html-italic">6</span>). Protease (gelatin hydrolysis, GH); lipase (lipid hydrolysis, LH); amylase (starch hydrolysis, SH); cellulase (cellulose hydrolysis, CH); Petri plates observed under visible and UV light. SDS-PAGE of total-cell protein (TP), broad-range protein molecular weight marker, Promega (M); densitometry plots (DP) for the SDS-PAGE gel.</p>
Full article ">Figure 4
<p>Biosurfactant production by native bacterial consortia. CoP1 cultured in MSM-diesel 1% (<span class="html-italic">1</span>), 5% (<span class="html-italic">2</span>), 10% (<span class="html-italic">3</span>); CoP2 cultured in MSM-diesel 1% (<span class="html-italic">4</span>), 5% (<span class="html-italic">5</span>), 10% (<span class="html-italic">6</span>). Diesel overlay (DoO), <span class="html-italic">n</span>-hexadecane overlay (HdO) and <span class="html-italic">n</span>-heptane overlay (HpO); CTAB agar; Petri plates observed under visible and UV light. HPTLC analysis of biosurfactants (Bs), showing the retardation factor (<span class="html-italic">R</span><sub>f</sub>) of chromatographic peaks (arrows) and the sugar standard L-rhamnose (S); TLC plates observed under UV (left, middle) and visible (right) light.</p>
Full article ">Figure 5
<p>Biodegradation of diesel by native bacterial consortia. CoP1 cultured in MSM-diesel 1% (<span class="html-italic">1</span>), 5% (<span class="html-italic">2</span>), 10% (<span class="html-italic">3</span>); CoP2 cultured in MSM-diesel 1% (<span class="html-italic">4</span>), 5% (<span class="html-italic">5</span>), 10% (<span class="html-italic">6</span>); control (C, uninoculated medium). HPTLC analysis of residual diesel (RD), showing the retardation factor (<span class="html-italic">R</span><sub>f</sub>) of chromatographic peaks (arrows); TLC plates observed under UV (left, middle) and visible (right) light.</p>
Full article ">
11 pages, 4211 KiB  
Communication
Investigation of the Influence of Adhesion Layers on the Gas Sensing Performance of CuO/Cu2O Thin Films
by Christian Maier, Larissa Egger, Anton Köck and Klaus Reichmann
Chemosensors 2025, 13(3), 80; https://doi.org/10.3390/chemosensors13030080 - 2 Mar 2025
Viewed by 289
Abstract
This parameter study examines the impact of two distinct adhesion layers, chromium (Cr) and titanium (Ti), on the performance of CuO/Cu2O-based chemoresistive gas sensors by varying the layer thickness. The sensing material utilised on a Si-SiO2 sensor chip with Pt [...] Read more.
This parameter study examines the impact of two distinct adhesion layers, chromium (Cr) and titanium (Ti), on the performance of CuO/Cu2O-based chemoresistive gas sensors by varying the layer thickness. The sensing material utilised on a Si-SiO2 sensor chip with Pt electrodes is an ultrathin CuO/Cu2O film fabricated through thermal deposition of Cu and subsequent oxidation. The sensors were evaluated by measuring the change in electrical resistance against a range of target gases, including carbon monoxide (CO), carbon dioxide (CO2) and a mixture of hydrocarbons (HCMix), in order to assess any potential cross-sensitivity issues. As the reactions occur at the surface, the surface was characterised by scanning electron microscopy (SEM) and the composition by grazing incidence X-Ray diffraction (GIXRD) measurement to gain further insight into the influence of the adhesion layer on the sensing performance. Full article
(This article belongs to the Special Issue Recent Advances in Metal Oxide-Based Gas Sensors)
Show Figures

Figure 1

Figure 1
<p>Illustration of the different layers of the Si-SiO<sub>2</sub> platform chip with Ti as adhesion layer for the Pt electrodes and, on top, the adhesion layer of Cr or Ti, with the oxidised CuO/Cu<sub>2</sub>O-sensing layer.</p>
Full article ">Figure 2
<p>SEM pictures of the sensors with different thicknesses of adhesion layers: (<b>a</b>) 5 nm thick Cr, (<b>b</b>) 15 nm thick Cr, (<b>c</b>) 25 nm thick Cr, (<b>d</b>) 5 nm thick Ti, (<b>e</b>) 15 nm thick Ti and (<b>f</b>) 25 nm thick Ti.</p>
Full article ">Figure 3
<p>SEM pictures of the surfaces with different thicknesses of adhesion layers: (<b>a</b>) 5 nm thick Cr, (<b>b</b>) 15 nm thick Cr, (<b>c</b>) 25 nm thick Cr, (<b>d</b>) 5 nm thick Ti, (<b>e</b>) 15 nm thick Ti and (<b>f</b>) 25 nm thick Ti.</p>
Full article ">Figure 4
<p>GIXRD measurement of the samples with different thicknesses of adhesion layers: 5 nm thick Cr, 15 nm thick Cr, 25 nm thick Cr, 5 nm thick Ti, 15 nm thick Ti and 25 nm thick Ti.</p>
Full article ">Figure 5
<p>Resistance measurement against 5, 10 and 20 ppm exposure of CO of the samples with different thicknesses of adhesion layers: (<b>a</b>) 5, 15 and 25 nm thick Cr; (<b>b</b>) 5, 15 and 25 nm thick Ti.</p>
Full article ">Figure 6
<p>Calculated sensor response average values of the 16 sensors with variation in the thicknesses (5, 15 and 25 nm) of Cr (<b>a</b>–<b>c</b>) and Ti (<b>d</b>–<b>f</b>) adhesion layers for the different gases: (<b>a</b>,<b>d</b>) 1000, 2000 and 4000 ppm of CO<sub>2</sub>; (<b>b</b>,<b>e</b>) 5, 10 and 20 ppm of CO; (<b>c</b>,<b>f</b>) 5, 10 and 20 ppm of HC<sub>Mix</sub>.</p>
Full article ">Figure 7
<p>Calculated sensor response average values of the 16 sensors with variation in the thicknesses (5, 15 and 25 nm) of Cr (<b>a</b>–<b>c</b>) and Ti (<b>d</b>–<b>f</b>) adhesion layers plotted against the test gas concentration: (<b>a</b>,<b>d</b>) 1000, 2000 and 4000 ppm of CO<sub>2</sub>; (<b>b</b>,<b>e</b>) 5, 10 and 20 ppm of CO; (<b>c</b>,<b>f</b>) 5, 10 and 20 ppm of HC<sub>Mix</sub>.</p>
Full article ">
25 pages, 4734 KiB  
Review
Features of the Composition, Release, Localization, and Environmental Effects of Free Gases in the Khibiny Massif (Kola Peninsula, Northwest Russia): A Review
by Valentin A. Nivin
Geosciences 2025, 15(3), 86; https://doi.org/10.3390/geosciences15030086 - 1 Mar 2025
Viewed by 146
Abstract
The article presents a comprehensive analysis of long-term studies on hydrogen-hydrocarbon free gases (FGs) in the rocks of the Khibiny massif, systematically organized and generalized for the first time. Gasometric observations were predominantly conducted within underground mine workings, with occasional measurements taken during [...] Read more.
The article presents a comprehensive analysis of long-term studies on hydrogen-hydrocarbon free gases (FGs) in the rocks of the Khibiny massif, systematically organized and generalized for the first time. Gasometric observations were predominantly conducted within underground mine workings, with occasional measurements taken during the drilling of exploration boreholes at the surface or in subsurface air within loose sediments. Methane is the primary component of these gases, followed in descending order by hydrogen, ethane, helium, other methane homologs, and alkenes. Nitrogen is also presumed to be present, although its proportions remain undefined. The carbon and hydrogen in FGs exhibit relatively heavy isotopic compositions, which progressively lighten from methane to ethane. The intensity of gas emissions is characterized by a gas flow rate from shot holes and boreholes, reaching up to 0.5 L/min but generally decreasing significantly within an hour of reservoir exposure. Gas-bearing areas, ranging in size from a few meters to tens of meters, are distributed irregularly and without discernible patterns. The FG content in rocks and ores varies from trace amounts to approximately 1 m3 of gas per cubic meter of undisturbed rock. These gases are primarily residual, preserved within microfractures and cavities following the isolation of fluid inclusions. Their distribution and composition may fluctuate due to the dynamic geomechanical conditions of the rock mass. The release of flammable and explosive FGs presents a significant hazard during ore deposit exploration and development, necessitating the implementation of rigorous safety measures for mining and drilling operations. Additionally, the environmental implications and potential applications of gas emissions warrant attention. Future comprehensive studies of the Khibiny gases using advanced methodologies and equipment are expected to address various scientific and practical challenges. Full article
Show Figures

Figure 1

Figure 1
<p>Schematic geological map of the Khibiny massif (based on the map of the Sevzapgeologiya production geological association). Rocks: 1—carbonatite, 2—alkaline syenite, 3—foyaite, 4—lyavochorrite, 5—ijolite–urtite, 6—apatite–nepheline ore, 7—rischorrite, 8—trachitoid khibinite, 9—massive khibinite, 10—fenitized metavolcanics and foidolites, 11—fenite after granite–gneiss, 12—proterozoic metavolcanics, 13—archean granite–gneiss; 14—subsurface air gas survey profiles [<a href="#B13-geosciences-15-00086" class="html-bibr">13</a>]; 15—areas of the soil H<sub>2</sub> survey [<a href="#B16-geosciences-15-00086" class="html-bibr">16</a>]. Apatite deposits (white-colored abbreviations): Pt—Partomchorr, Kp—Kuelporr, SC—Snezhnyj Circus, Kk—Kukisvumchorr, Yk—Yuksporr, AC—Apatite Circus, RP—Rasvumchorr Plateau, Ev—Eveslogchorr, Kv—Koashva, Np—Nyorpakhk, OR—Oleniy Ruchei.</p>
Full article ">Figure 2
<p>Methane and hydrogen emission rates in the active face of the exploration drift, Kukisvumchorr deposit.</p>
Full article ">Figure 3
<p>Change in the content of gas components in the outgoing ventilation jet after a massive explosion, Yuksporr deposit. N<sub>i</sub>O<sub>k</sub>—nitrogen oxides produced by explosions.</p>
Full article ">Figure 4
<p>Ratios of methane and molecular hydrogen in the FGs of shot hole No. 19 (<b>a</b>), wells No. 1253 (<b>b</b>) and No. 539 (<b>c</b>).</p>
Full article ">Figure 5
<p>Distribution of gases in the rocks of the Apatite Circus deposit, the walls of underground mine workings (cross gangways), horizons + 530 m ((<b>a</b>)—modified after [<a href="#B3-geosciences-15-00086" class="html-bibr">3</a>]) and +470 m (<b>b</b>). 1—occluded gas content; 2—free gas flow rate in shot holes; rocks: 3—rischorrite; 4—apatite-nepheline ore; 5—urtite.</p>
Full article ">Figure 6
<p>The distribution pattern of CH<sub>4</sub> in the subsoil atmosphere along the SW-NE-E generalized cross-section through the Khibiny massif. 1—carbonatite, 2—foyaite, 3—lyavochorrite, 4—ijolite–urtite, 5—rischorrite, 6 and 7—trachitoid and massive khibinites, 8—fenitized metavolcanics and foidolites, 9—fenite after granite–gneiss, 10—proterozoic metavolcanics, 11—CH<sub>4</sub> concentrations.</p>
Full article ">Figure 7
<p>Relationship of CH<sub>4</sub> (<b>a</b>) and CH<sub>4</sub>/H<sub>2</sub> (<b>b</b>) distribution of free and occluded gases in the Khibiny rocks.</p>
Full article ">Figure 8
<p>Molecular weight distribution of alkanes in the Khibiny, Lovozero, and thermogenic gases. 1 and 2—occluded gases of the Khibiny foidolites and nepheline syenites (rischorrites and lyavochorrites), respectively [<a href="#B17-geosciences-15-00086" class="html-bibr">17</a>]; 3 and 4—the Khibiny free gases from foidolites and nepheline syenites, respectively; 5 and 6—free gases of the Lovozero massif [<a href="#B8-geosciences-15-00086" class="html-bibr">8</a>]; 7—gas fields of Western Siberia [<a href="#B34-geosciences-15-00086" class="html-bibr">34</a>]; 8 and 9—oil-type and coal-type gases in the northern Dongpu Depression, Bohai Bay Basin, China [<a href="#B35-geosciences-15-00086" class="html-bibr">35</a>].</p>
Full article ">
19 pages, 7322 KiB  
Article
Phytochemical-Mediated Ah Receptor Activity Is Dependent on Dietary Context
by Fangcong Dong, Andrew J. Annalora, Iain A. Murray, Debopriya Chakraborty, Denise M. Coslo, Craig Marcus, Andrew D. Patterson and Gary H. Perdew
Nutrients 2025, 17(5), 876; https://doi.org/10.3390/nu17050876 - 28 Feb 2025
Viewed by 244
Abstract
Background/Objective: The aryl hydrocarbon receptor (AHR) is an important mediator of intestinal homeostasis. The AHR senses certain classes of phytochemicals, including many flavonoids and tryptophan metabolites generated in the intestinal tract. Several in vitro studies demonstrate the presence of AHR ligands in numerous [...] Read more.
Background/Objective: The aryl hydrocarbon receptor (AHR) is an important mediator of intestinal homeostasis. The AHR senses certain classes of phytochemicals, including many flavonoids and tryptophan metabolites generated in the intestinal tract. Several in vitro studies demonstrate the presence of AHR ligands in numerous plants commonly consumed by humans. However, it has not been established that these foods can activate the AHR in vivo. The aim of this study was to evaluate how phytochemicals in foods can lead to AHR activation in vivo through modulating CYP1A1 activity. Methods: Freeze-dried spinach, corn, red potatoes, kidney beans, parsley, onion, carrots, bell peppers, and broccoli were fed to C57BL6/J female mice at 15% w/w in a semi-purified diet to evaluate the AHR activation potential. In vitro CYP1A1 microsomal assays were utilized to establish specific phytochemicals as CYP1A1 substrates. Results: Broccoli, onion, and carrots increased expression of the AHR target gene Cyp1a1 in the duodenum. Broccoli consumption led to the formation of the potent AHR ligand indolo[3,2-b]carbazole (ICZ), which is also a CYP1A1 substrate. Relative to the other vegetables, parsley contained a high concentration of apiin, a diglycoside of the flavone apigenin. Mice were fed a diet with either 10% parsley, 10% broccoli, or both vegetables. Parsley consumption increased broccoli-mediated Cyp1a1 induction in the duodenum, liver, and lung. Apigenin is a CYP1A1 substrate that can attenuate ICZ metabolism in vitro and increase broccoli-mediated Cyp1a1 expression in the lung. Conclusions: These results suggest that phytochemical competition for intestinal AHR binding and CYP1A1 metabolism modulates systemic AHR activity. Full article
(This article belongs to the Section Nutrition and Metabolism)
Show Figures

Figure 1

Figure 1
<p>Some common foods are capable of increasing AHR activation in the intestinal tract. Foods as indicated were added at 15% on a dry weight basis to a semi-purified diet and fed to mice for 3 days. Duodenum and colonic tissues were isolated and RNA extracted, followed by qRT-PCR determination of the <span class="html-italic">Cyp1a1</span> mRNA levels. The data are the mean ± SEM, one-way ANOVA, Tukey’s test, * <span class="html-italic">p</span> &lt; 0.05, ** <span class="html-italic">p</span> &lt; 0.01. Alphabetical characters indicate statistical comparisons between two groups.</p>
Full article ">Figure 2
<p>Assessment of the flavonoid-mediated agonist activity in an AHR-driven reporter cell line. The ability of 13 flavonoids at 10 µM to increase AHR activity was assessed in the Hepa 1.1 AHR reporter cell line. Cells were treated for 4 h with each flavonoid, compared to 2 nM TCDD as a positive control, and the luciferase activity was determined. The data are the mean ± SEM, one-way ANOVA, Tukey’s test, **** <span class="html-italic">p</span> &lt; 0.0001.</p>
Full article ">Figure 3
<p>Flavonoids differentially inhibit CEE-luciferin metabolism in a Hepa 1 microsomal assay system. Thirteen abundant flavonoids were assessed for the ability to inhibit CEE-luciferin metabolism in an in vitro microsomal assay system. The data are the mean ± SEM, one-way ANOVA, Tukey’s test, *** <span class="html-italic">p</span> &lt; 0.001, **** <span class="html-italic">p</span> &lt; 0.0001. Alphabetical characters indicate statistical comparisons between two groups.</p>
Full article ">Figure 4
<p>Parsley enhances broccoli-mediated <span class="html-italic">Cyp1a1</span> expression in the duodenum, liver and lung. Parsley, broccoli, or parsley + broccoli at 10% each in a semi-purified diet were fed for 7 days. RNA was isolated from the duodenum, colon, liver, and lung; qRT-PCR assessed the level of <span class="html-italic">Cyp1a1</span> expression. The data are the mean ± SEM, one-way ANOVA, Tukey’s test, * <span class="html-italic">p</span> &lt; 0.05, ** <span class="html-italic">p</span> &lt; 0.01, *** <span class="html-italic">p</span> &lt; 0.001, **** <span class="html-italic">p</span> &lt; 0.0001. Alphabetical characters indicate statistical comparisons between two groups.</p>
Full article ">Figure 5
<p>Presence of apigenin in the intestinal tract and in the serum after parsley consumption. LC/MS/MS analysis revealed that a 10% parsley/semi-purified diet led to the presence of apigenin in cecal and fecal matter (<b>A</b>). A 10% parsley or a 10% broccoli + 10% parsley diet resulted in apigenin serum levels in a low µM range (<b>B</b>). Apigenin was less than the limit of detection (&lt;LOD) in a purified and broccoli diet.</p>
Full article ">Figure 6
<p>Apigenin, but not apiin, inhibits CEE-luciferin metabolism in a microsomal assay system. Increasing concentrations of apigenin or apiin were added to either the human (Caco2) or mouse (Hepa1) in vitro microsomal assay system and the luciferase activity was measured. α-NF was utilized as a positive control. The data are the mean ± SEM, one-way ANOVA, Tukey’s test, ** <span class="html-italic">p</span> &lt; 0.01, *** <span class="html-italic">p</span> &lt; 0.001, **** <span class="html-italic">p</span> &lt; 0.0001. Alphabetical characters indicate statistical comparisons between two groups.</p>
Full article ">Figure 7
<p>Apigenin docking in human and mouse CYP1A1. The substrate binding properties of apigenin were explored using Autodock (versions 4.2 and Vina) and molecular models of human CYP1A1 (hCYP1A1) and mouse CYP1A1 (mCYP1A1), which were created using the crystal structure of CYP1A1 (1TQN; see <a href="#sec2-nutrients-17-00876" class="html-sec">Section 2</a>). Apigenin docks to the CYP1A1 active site with low nanomolar affinity in both human (−11.2 kcal/mol; 6.3 nM; green stick) and mouse (−11.1 kcal/mol; or 7.5 nM; <a href="#nutrients-17-00876-t001" class="html-table">Table 1</a>) forms of the enzyme (see <a href="#nutrients-17-00876-t001" class="html-table">Table 1</a>). Here, the most common binding pose for apigenin is shown (−11.2 kcal/mol; green stick) in the CYP1A1 active site formed by amino acids I115, S116, S122, F123, F224, V228, F251, L254, N255, F258, D313, A317, D320, T321, V382, L496, and T497. The species-specific amino acid differences between the human and mouse CYP1A1 active site are limited to 3 residues (S116, S122 and V228), which are highlighted (purple lines) (<b>A</b>). Apigenin interacts with a cluster of highly conserved, hydrophobic residues (I115, F123, F224, V228, F251, L254, F258, A317, V382, L496) that define the narrow, active site pocket of both hCYP1A1 and mCYP1A1 (<b>B</b>). For the most common binding configuration (−11.2 kcal/mol; green stick), apigenin’s B-ring is positioned over the heme center, with the C3 and C5 target carbons in proximity (5.2–5.5 Å, respectively) for oxidation (<b>C</b>). A lower energy, but less common, docking solution (−11.4 kcal/mol; yellow stick) was also obtained for apigenin in the human model, but not in the mouse model. In this low-energy solution, the A-ring of apigenin is positioned over the heme, placing the C6 carbon within 4.7 Å of the heme center (<b>D</b>). Despite this outlier, apigenin docking was generally consistent for both mCYP1A1 and hCYP1A1, using either version of Autodock. Minor differences among the interactions between the substrate and the polymorphic active site residues S116(T), V228(T), and S122(T) were detected but did not significantly alter the terminal substrate positioning. Here, the nearly identical Autodock 4.2 results for mouse and human CYP1A1 are shown (hCYP1A1: 107 nM; −9.5 kcal/mol (orange stick); and mCYP1A1: 90 nM; −9.6 kcal/mol (light green stick), with the C3 target carbon of apigenin positioned 6.2–6.3 Å from the heme center, respectively) (<b>E</b>). Autodock Vina predicted lower energy binding of apigenin to hCYP1A1 than Autodock 4.2 (−11.2 kcal/mol (green stick) vs. −9.5 kcal/mol (orange stick), respectively), but both programs consistently positioned the C3 or C5 target carbons of the B-ring ~5.2–6.3 Å from the heme center (<b>F</b>).</p>
Full article ">Figure 8
<p>Apigenin can inhibit ICZ metabolism. The Hepa 1 microsomal assay system is capable of metabolizing apigenin to luteolin, and ICZ to dihydroxyICZ (<b>A</b>). Apigenin was incubated with the microsomal assay system under the conditions given for 120 min. LC-MS/MS was utilized to assess the level of apigenin (<b>B</b>), luteolin (<b>C</b>), and dihydroxyICZ (<b>D</b>). The data are the mean ± SEM, one-way ANOVA, Tukey’s test, ** <span class="html-italic">p</span> &lt; 0.01, *** <span class="html-italic">p</span> &lt; 0.001, **** <span class="html-italic">p</span> &lt; 0.0001. Alphabetical characters indicate statistical comparisons between two groups.</p>
Full article ">Figure 9
<p>Dietary apigenin is capable of increasing the lung <span class="html-italic">Cyp1a1</span> levels in the presence of broccoli. Here, 10% broccoli or 10% broccoli + 5 mg/g of apigenin in a powdered diet was fed to mice for 3 days and the <span class="html-italic">Cyp1a1</span> levels were assessed in duodenal scrapes, colonic scrapes, liver and lung. The data are the mean ± SEM, Student’s <span class="html-italic">t</span> test, * <span class="html-italic">p</span> &lt; 0.05. Alphabetical characters indicate statistical comparisons between two groups.</p>
Full article ">
Back to TopTop