Partitioning
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Knowledge regarding partitioning behavior and bioaccumulation potential of environmental contaminants is important for ecological and human health risk assessment. While a range of models are available to describe bioaccumulation potential of hydrophobic organic chemicals (HOCs) in temperate aquatic food webs, their applicability to tropical systems still needs to be validated. The present study involved field investigations to assess the occurrence, partitioning, and bioaccumulation behavior of several legacy and emerging HOCs in mangrove ecosystems in Singapore. Concentrations of synthetic musk fragrance compounds, methyl triclosan (MTCS), polychlorinated biphenyls, organochlorine pesticides, and polycyclic aromatic hydrocarbons were measured in mangrove sediments, clams, and caged mussels. Freely dissolved concentrations of the HOCs in water were determined using silicone rubber passive samplers. Results showed that polycyclic musks and MTCS are present in mangrove ecosystems and can accumulate in the tissues of mollusks. The generated HOC concentration data for mangrove water, sediments, and biota samples was further utilized to evaluate water-sediment partitioning (e.g., Koc values) and bioaccumulation behavior (e.g., BAF and BSAF values). Overall, the empirical models fit reasonably well with the data obtained for this ecosystem, supporting the concept that general models are applicable to predict the behavior of legacy and emerging HOCs in mangrove ecosystems.
- MeSH
- chemické látky znečišťující vodu * MeSH
- ekosystém MeSH
- geologické sedimenty MeSH
- monitorování životního prostředí MeSH
- organické látky MeSH
- polychlorované bifenyly * MeSH
- polycyklické aromatické uhlovodíky * MeSH
- zvířata MeSH
- Check Tag
- zvířata MeSH
- Publikační typ
- časopisecké články MeSH
- práce podpořená grantem MeSH
Vessels with simple perforation plates, found in the majority of angiosperms, are considered the evolutionarily most advanced conduits, least impeding the xylem sap flow. Nevertheless, when measured, their hydraulic resistivity (R, i.e., inverse value of hydraulic conductivity) is significantly higher than resistivity predicted using Hagen-Poiseuille equation (RHP). In our study we aimed (i) to quantify two basic components of the total vessel resistivity - vessel lumen resistivity and end wall resistivity, and (ii) to analyze how the variable inner diameter of the vessel along its longitudinal axis affects resistivity. We measured flow rates through progressively shortened stems of hop (Humulus lupulus L.), grapevine (Vitis vinifera L.), and clematis (Clematis vitalba L.) and used elastomer injection for identification of open vessels and for measurement of changing vessel inner diameters along its axis. The relative contribution of end wall resistivity to total vessel resistivity was 0.46 for hop, 0.55 for grapevine, and 0.30 for clematis. Vessel lumen resistivity calculated from our measurements was substantially higher than theoretical resistivity - about 43% for hop, 58% for grapevine, and 52% for clematis. We identified variation in the vessel inner diameter as an important source of vessel resistivity. The coefficient of variation of vessel inner diameter was a good predictor for the increase of the ratio of integral RHP to RHP calculated from the mean value of inner vessel diameter. We discuss the fact that we dealt with the longest vessels in a given stem sample, which may lead to the overestimation of vessel lumen resistivity, which consequently precludes decision whether the variable vessel inner diameter explains fully the difference between vessel lumen resistivity and RHP we observed.
Polymers are increasingly used for passive sampling of neutral hydrophobic organic substances (HOC) in environmental media including water, air, soil, sediment and even biological tissue. The equilibrium concentration of HOC in the polymer can be measured and then converted into equilibrium concentrations in other (defined) media, which however requires appropriate polymer to media partition coefficients. We determined thus polymer-lipid partition coefficients (KPL) of various PCB, PAH and organochlorine pesticides by equilibration of two silicones and low density polyethylene (LDPE) with fish oil and Triolein at 4 °C and 20 °C. We observed (i) that KPLwas largely independent of lipid type and temperature, (ii) that lipid diffusion rates in the polymers were higher compared to predictions based on their molecular volume, (iii) that silicones showed higher lipid diffusion and lower lipid sorption compared to LDPE and (iv) that absorbed lipid behaved like a co-solute and did not affect the partitioning of HOC at least for the smaller molecular size HOC. The obtained KPLcan convert measured equilibrium concentrations in passive sampling polymers into equilibrium concentrations in lipid, which then can be used (1) for environmental quality monitoring and assessment, (2) for thermodynamic exposure assessment and (3) for assessing the linkage between passive sampling and the traditionally measured lipid-normalized concentrations in biota. LDPE-lipid partition coefficients may also be of use for a thermodynamically sound risk assessment of HOC contained in microplastics.
- MeSH
- chlorované uhlovodíky chemie izolace a purifikace MeSH
- fyzikální absorpce * MeSH
- hydrofobní a hydrofilní interakce MeSH
- látky znečišťující životní prostředí chemie izolace a purifikace MeSH
- lipidy chemie MeSH
- organické látky chemie izolace a purifikace MeSH
- polyethylen chemie MeSH
- regenerace a remediace životního prostředí metody MeSH
- silikony chemie MeSH
- vystavení vlivu životního prostředí prevence a kontrola MeSH
- Publikační typ
- časopisecké články MeSH
There is an increasing awareness of the threats posed by the worldwide presence of microplastics (MPs) in the environment. Due to their high persistence, MPs will accumulate in the environment and their quantities tend to increase with time. MPs end up in environments where often also chemical contaminants are present. Since the early 2000s, the number of studies on the sorption of chemicals to plastic particles has exponentially increased. The objective of this study was to critically review the literature to identify the most important factors affecting the sorption of chemical contaminants to MPs. These factors include the physicochemical properties of both the MPs and the chemical contaminants as well as environmental characteristics. A limited number of studies on soil together with an increased notion of the importance of this compartment as a final sink for MPs was observed. Therefore, we assessed the distribution of model chemicals (two PCBs and phenanthrene) in the soil compartment in the presence of MPs using a mass balance model. The results showed a high variation among chemicals and microplastic types. Overall, a higher partitioning to MPs of chemical contaminants in soil is expected in comparison to aquatic environments. As sorption to a large extent determines bioavailability, the effects of combined exposure to chemicals and MPs on the toxicity and bioaccumulation in biota are discussed. Finally, some considerations regarding sorption and toxicity studies using MPs are given.
- MeSH
- biologická dostupnost MeSH
- chemické látky znečišťující vodu analýza MeSH
- chemické modely MeSH
- fenantreny analýza MeSH
- lidé MeSH
- monitorování životního prostředí MeSH
- plastické hmoty analýza MeSH
- polychlorované bifenyly analýza MeSH
- půda chemie MeSH
- společenstvo MeSH
- vystavení vlivu životního prostředí škodlivé účinky MeSH
- Check Tag
- lidé MeSH
- Publikační typ
- časopisecké články MeSH
- přehledy MeSH
A model for gas-particle partitioning of polycyclic aromatic hydrocarbons (PAHs) was evaluated using polyparameter linear free energy relationships (ppLFERs) following a multiphase aerosol scenario. The model differentiates between various organic (i.e., liquid water-soluble (WS)/organic soluble (OS) organic matter (OM), and solid/semisolid organic polymers) and inorganic phases of the particulate matter (PM). Dimethyl sulfoxide and polyurethane were assigned as surrogates to simulate absorption into the above-mentioned organic phases, respectively, whereas soot, ammonium sulfate, and ammonium chloride simulated adsorption processes onto PM. The model was tested for gas and PM samples collected from urban and nonurban sites in Europe and the Mediterranean, and the output was compared with those calculated using single-parameter linear free energy relationship (spLFER) models, namely Junge-Pankow, Finizio, and Dachs-Eisenreich. The ppLFER model on average predicted 96 ± 3% of the observed partitioning constants for semivolatile PAHs, fluoranthene, and pyrene, within 1 order of magnitude accuracy with root-mean-square errors (RMSE) of 0.35-0.59 across the sites. This was a substantial improvement compared to Finizio and Dachs-Eisenreich models (37 ± 17 and 46 ± 18% and RMSE of 1.03-1.40 and 0.94-1.36, respectively). The Junge-Pankow model performed better among spLFERs but at the same time showed an overall tendency for overestimating the partitioning constants. The ppLFER model demonstrated the best overall performance without indicating a substantial intersite variability. The ppLFER analysis with the parametrization applied in this study suggests that the absorption into WSOSOM could dominate the overall partitioning process, while adsorption onto salts could be neglected.
Plants have developed many ways to protect reaction centres of photosystems against overexcitation. One of the mechanisms involves reduction of the leaf absorption cross-section by light-induced chloroplast avoidance reaction. Decrease in the probability of photon absorption by the pigments bound within photosystem II (PSII) complexes leads to the increase in quantum yield of PSII photochemistry (ΦPSII). On the other hand, the decrease of PSII excitation probability causes reduction of chlorophyll a fluorescence intensity which is manifested as the apparent increase of determined quantum yield of regulated light-induced non-photochemical quenching (ΦNPQ). Absorption of different light intensity by phototropins led to the different chloroplast distribution within barley leaves, estimated by measurement of the leaf transmittance. Due to a weak blue light used for transmittance measurements, leaves exposed to actinic light with wavelengths longer than 520 nm undergo chloroplast accumulation reaction, in contrast with leaves exposed to light with shorter wavelengths, that showed a different extent of chloroplast avoidance reaction. Based on the ΦNPQ action spectra measured simultaneously with the transmittance, the influence of different chloroplast distribution on ΦNPQ was assessed. The analysis of results showed that decrease in the leaf absorption cross-section due to increasing part of chloroplasts reaching profile position significantly affected the partitioning of excitation energy within PSII and such rearrangement also distorted measured ΦNPQ and cannot be neglected in its interpretation. When the majority of chloroplasts reached profile position, the photoprotective effect appeared to be the most prominent for strong blue light that has the highest absorption in the upper leaf layers in comparison with green or red ones.
Almost every laboratory dealing with plant physiology, photosynthesis research, remote sensing, and plant phenotyping possesses a fluorometer to measure a kind of chlorophyll (Chl) fluorescence induction (FLI). When the slow Chl FLI is measured with addition of saturating pulses and far-red illumination, the so-called quenching analysis followed by the so-called relaxation analysis in darkness can be realized. These measurements then serve for evaluation of the so-called energy partitioning, that is, calculation of quantum yields of photochemical and of different types of non-photochemical processes. Several theories have been suggested for photosynthetic energy partitioning. The current work aims to summarize all the existing theories, namely their equations for the quantum yields, their meaning and their assumptions. In the framework of these theories it is also found here that the well-known NPQ parameter ( [Formula: see text] ; Bilger and Björkman, 1990) equals the ratio of the quantum yield of regulatory light-induced non-photochemical quenching to the quantum yield of constitutive non-regulatory non-photochemical quenching (ΦNPQ/Φf,D). A similar relationship is also found here for the PQ parameter (ΦP/Φf,D).
- MeSH
- chlorofyl metabolismus MeSH
- energetický metabolismus MeSH
- fluorescence MeSH
- fotosyntéza fyziologie účinky záření MeSH
- fotosystém II (proteinový komplex) metabolismus MeSH
- listy rostlin fyziologie účinky záření MeSH
- světlo MeSH
- Publikační typ
- časopisecké články MeSH
- práce podpořená grantem MeSH
- přehledy MeSH
Over the past decade, molecular dynamics (MD) simulations have become particularly powerful to rationalize drug insertion and partitioning in lipid bilayers. MD simulations efficiently support experimental evidences, with a comprehensive understanding of molecular interactions driving insertion and crossing. Prediction of drug partitioning is discussed with respect to drug families (anesthetics; β-blockers; non-steroidal anti-inflammatory drugs; antioxidants; antiviral drugs; antimicrobial peptides). To accurately evaluate passive permeation coefficients turned out to be a complex theoretical challenge; however the recent methodological developments based on biased MD simulations are particularly promising. Particular attention is paid to membrane composition (e.g., presence of cholesterol), which influences drug partitioning and permeation. Recent studies concerning in silico models of membrane proteins involved in drug transport (influx and efflux) are also reported here. These studies have allowed gaining insight in drug efflux by, e.g., ABC transporters at an atomic resolution, explicitly accounting for the mandatory forces induced by the surrounded lipid bilayer. Large-scale conformational changes were thoroughly analyzed.
- MeSH
- biologický transport MeSH
- buněčná membrána metabolismus MeSH
- cytoplazma metabolismus MeSH
- léčivé přípravky metabolismus MeSH
- léková rezistence MeSH
- lidé MeSH
- lipidové dvojvrstvy metabolismus MeSH
- membránové proteiny metabolismus MeSH
- počítačová simulace MeSH
- Check Tag
- lidé MeSH
- Publikační typ
- časopisecké články MeSH
- práce podpořená grantem MeSH
- přehledy MeSH
Among the nitrated and oxygenated polycyclic aromatic hydrocarbons (NPAHs and OPAHs) are some of the most hazardous substances to public health, mainly because of their carcinogenicity and oxidative potential. Despite these concerns, the concentrations and fate of NPAHs and OPAHs in the atmospheric environment are largely unknown. Ambient air concentrations of 18 NPAHs, 5 quinones, and 5 other OPAHs were determined at two urban and one regional background sites in central Europe. At one of the urban sites, the total (gas and particulate) concentrations of Σ10OPAHs were 10.0 ± 9.2 ng/m3 in winter and 3.5 ± 1.6 ng/m3 in summer. The gradient to the regional background site exceeded 1 order of magnitude. Σ18NPAH concentrations were typically 1 order of magnitude lower than OPAHs. Among OPAHs, 9-fluorenone and (9,10)-anthraquinone were the most abundant species, accompanied by benzanthrone in winter. (9,10)-Anthraquinone represented two-thirds of quinones. We found that a large fraction of the target substance particulate mass was carried by submicrometer particles. The derived inhalation bioaccessibility in the PM10 size fraction is found to be ≈5% of the total ambient concentration of OPAHs and up to ≈2% for NPAHs. For 9-fluorenone and (9,10)-anthraquinone, up to 86 and 18%, respectively, were found at the rural site. Our results indicate that water solubility could function as a limiting factor for bioaccessibility of inhaled particulate NPAHs and OPAHs, without considerable effect of surfactant lipids and proteins in the lung lining fluid.
- MeSH
- dusičnany MeSH
- látky znečišťující vzduch * MeSH
- lidé MeSH
- monitorování životního prostředí MeSH
- pevné částice MeSH
- polycyklické aromatické uhlovodíky * MeSH
- Check Tag
- lidé MeSH
- Publikační typ
- časopisecké články MeSH
- práce podpořená grantem MeSH
- Geografické názvy
- Evropa MeSH
