Search results for "WATER"

Single Molecule Study of GFP-mut2 Proteins Caged in Trehalose-Water Matrixes: Spatially Inhomogeneous Protein-Water-Sugar Structures

2007

Explicit proton transfer in classical molecular dynamics simulations.

2014

We present Hydrogen Dynamics (HYDYN), a method that allows explicit proton transfer in classical force field molecular dynamics simulations at thermodynamic equilibrium. HYDYN reproduces the characteristic properties of the excess proton in water, from the special pair dance, to the continuous fluctuation between the limiting Eigen and Zundel complexes, and the water reorientation beyond the first solvation layer. Advantages of HYDYN with respect to existing methods are computational efficiency, microscopic reversibility, and easy parameterization for any force field peerReviewed

Effect of seawater salt on the protonation of some classes of ligands

2004

Odorous volatile organic compounds in waste and wastewater management

2012

Extraction Methods of Essential Oils From Herbs and Spices

2017

International audience; This chapter describes both conventional and non‐conventional extraction methods of essential oils (EOs) from herbs and spices. Although hydrodistillation, steam distillation and solvent extraction are the most applied methods, several non‐conventional technologies have been evaluated, especially in respect to EO recovery, and a great potential has been attributed to these non‐conventional methods. For instance, ultrasound, microwave, supercritical fluid, pulsed electric fields, ohmic‐heating and microwave (MW) extraction techniques applied alone or combined with other techniques are potent tools to obtain EOs in a 'green' way from natural resources such as aromatic …

Water Dynamics in Biological Systems investigated using Neutron Scattering Techniques

Living systems can not survive in absence of the water environments which play a fundamental role in living functions. Thus in the scienti?c community many studies were and are addressed to characterize water and its dynamics properties in biological systems. However, a clear description of water in such systems has been not reached yet. In fact, the investigations performed with di?erent techniques - those based on Nuclear Magnetic Resonance or those based on Neutron Scattering - look at di?erent di?usive motions and interactions water-biomolecules, leading controversial results and hence generating many debates between scientists. In this thesis we support the idea that two water populati…

Phenolic Profiles, Antioxidant and Anti-Inflammatory Activities of Hydrodistillation Wastewaters from Five Lamiaceae Species

2022

Distillation is the most widely used method to obtain an essential oil from plant material. The biomass used in the process is returned as a solid residue together with variable amounts of water rich in water-soluble compounds, which currently are not addressed to any further application. The scope of this work was to evaluate the phytochemical composition of wastewaters coming from hydrodistillation (DWWs) of five aromatic plants belonging to the Lamiaceae family, and to assess their in vitro antioxidant and anti-inflammatory activities. The phenolic profiles of the DWWs were determined by HPLC-DAD and HPLC-ESI/MS. Free radical scavenging ability, oxygen radical antioxidant capacity and su…

Chemical and isotopic characterization of rainwater in volcanic, urban and industrial areas of Sicily (Italy)

2021

The chemical composition of rainwater depends on (i) the dissolution of gases and particulate matter emitted by different sources, (ii) the chemical and physical reactions occurring during local and regional scale transport, and (iii) removal processes. The source of major and trace elements dissolved in rainwater can be both natural (e.g. sea salts, volcanic emissions, geogenic dust, biogenic material) and anthropogenic (e.g. industrial plants, vehicular traffic, domestic heating, vessel traffic). A group of trace elements has been recently brought to attention, especially for their possible environmental impacts, the Technology-critical elements (TCEs): Ga, Ge, In, Te, Nb, Ta, Tl, the Pla…

The south coast of Palermo. Planning the resilient city

2017

Il contributo individua i temi progettuali per la definizione di temi di progetto sul territorio della cosiddetta "costa sud" della città di Palermo. Il contributo descrive i temi di sviluppo, analizza le risorse presenti e definisce alcuni elementi progettuali che verranno sviluppati sia all'interno della ricerca presentata nel volume, sia nelle politiche di trasformazione urbana del Comune di Palermo. The paper identifies the design themes for project in the so-called "south coast" of the city of Palermo. The contribution describes the development themes, analyzes the resources present and defines some design elements that will be developed both within the research presented in the volume…

Biological and Proteomic Characterization of the Anti-Cancer Potency of Aqueous Extracts from Cell-Free Coelomic Fluid of Arbacia lixula Sea Urchin i…

2022

Echinoderms are an acknowledged source of bioactive compounds exerting various beneficial effects on human health. Here, we examined the potential in vitro anti-hepatocarcinoma effects of aqueous extracts of the cell-free coelomic fluid obtained from the sea urchin Arbacia lixula using the HepG2 cell line as a model system. This was accomplished by employing a combination of colorimetric, microscopic and flow cytometric assays to determine cell viability, cell cycle distribution, the possible onset of apoptosis, the accumulation rate of acidic vesicular organelles, mitochondrial polarization, cell redox state and cell locomotory ability. The obtained data show that exposed HepG2 cells under…