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Wyświetlanie 1-15 z 97
Tytuł:
Influence of Volume Drop on Surface Free Energy of Glass
Autorzy:
Rymuszka, Diana
Terpiłowski, Konrad
Hołysz, Lucyna
Powiązania:
https://bibliotekanauki.pl/articles/951384.pdf
Data publikacji:
2013
Wydawca:
Uniwersytet Marii Curie-Skłodowskiej. Wydawnictwo Uniwersytetu Marii Curie-Skłodowskiej
Tematy:
contact angle
surface free energy
Opis:
The aim of the research was to determine how the drop size affects the contact angle values and determine its optimal size for further contact angle measurements and comparison of the contact angle values measured for three probe liquids (water, formamide, diiodomethane) on the glass surface using the: sessile drop and tilting plate methods. Next, using the measured contact angles, the total surface free energy and its components were determined from the van Oss et al. (Lifshitz-van der Waals acid- base component, LWAB), Owens-Wendt, Neumann and contact angle hysteresis (CAH) approaches. The studies showed, that drop size is very important for contact angle measurements and consequently, for surface free energy estimation.
Źródło:
Annales Universitatis Mariae Curie-Skłodowska, sectio AA – Chemia; 2013, 68, 1-2
2083-358X
Pojawia się w:
Annales Universitatis Mariae Curie-Skłodowska, sectio AA – Chemia
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Effect of chitosan and lipid layers deposited onto polyethylene terephthalate (pet) on its wetting properties
Autorzy:
Szafran, Klaudia
Jurak, Małgorzata
Wiącek, Agnieszka Ewa
Powiązania:
https://bibliotekanauki.pl/articles/2131531.pdf
Data publikacji:
2021
Wydawca:
Sieć Badawcza Łukasiewicz - Polskie Towarzystwo Chitynowe
Tematy:
chitosan
surface free energy
wettability
Opis:
The wetting properties of chitosan (Ch) and single 1,2-dipalmitoylsn-glycero-3-phosphocholine (DPPC), cholesterol (Chol) and binary DPPC-Chol layers deposited onto polyethylene terephthalate activated by low-temperature air plasma (PETair) were examined. PET is widely used in tissue engineering, but its low hydrophilicity limits its integration with the surrounding tissues. Ch is a biocompatible polysaccharide, distinguished by its antimicrobial properties, widely distributed in medicine. DPPC and Chol are the major building components of cell membrane, so they can perfectly mimic membrane behaviour during contact with the Ch layer. Monolayers of lipids were deposited onto PETair with or without the Ch layer using the Langmuir-Blodgett technique. The total surface free energy (SFE) and its components changes were calculated from theoretical approaches. Wettability strongly depended on the monolayer composition as well as the Ch layer. The Ch film decreased the contact angle and increased SFE of the PET surface with the lipid monolayers due to specific organisation of molecules within the chitosan scaffold. The most promising combination of surface modification for tissue engineering applications seems to be the PETair/Ch/DPPC-Chol system.
Źródło:
Progress on Chemistry and Application of Chitin and its Derivatives; 2021, 26; 210-221
1896-5644
Pojawia się w:
Progress on Chemistry and Application of Chitin and its Derivatives
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
A simple model for predicting the free energy of binding between anthracycline antibiotics and DNA.
Autorzy:
Rudnicki, Witold
Kurzepa, Małgorzata
Szczepanik, Teresa
Priebe, Waldemar
Lesyng, Bogdan
Powiązania:
https://bibliotekanauki.pl/articles/1044384.pdf
Data publikacji:
2000
Wydawca:
Polskie Towarzystwo Biochemiczne
Tematy:
anthracyclines
free energy
modelling
DNA
Opis:
A theoretical model for predicting the free energy of binding between anthracycline antibiotics and DNA was developed using the electron density functional (DFT) and molecular mechanics (MM) methods. Partial DFT-ESP charges were used in calculating the MM binding energies for complexes formed between anthracycline antibiotics and oligodeoxynucleotides. These energies were then compared with experimental binding free energies. The good correlation between the experimental and theoretical energies allowed us to propose a model for predicting the binding free energy for derivatives of anthracycline antibiotics and for quickly screening new anthracycline derivatives.
Źródło:
Acta Biochimica Polonica; 2000, 47, 1; 1-9
0001-527X
Pojawia się w:
Acta Biochimica Polonica
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Contact angle and surface free energy of fresh and stored pig’s skin
Autorzy:
Liber-Kneć, A.
Łagan, S.
Powiązania:
https://bibliotekanauki.pl/articles/285482.pdf
Data publikacji:
2017
Wydawca:
Akademia Górniczo-Hutnicza im. Stanisława Staszica w Krakowie. Polskie Towarzystwo Biominerałów
Tematy:
skin tissue
surface free energy
biomaterials
Źródło:
Engineering of Biomaterials; 2017, 20, no. 143 spec. iss.; 10
1429-7248
Pojawia się w:
Engineering of Biomaterials
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Prediction of binding affinities for DNA intercalators by molecular dynamics simulations
Autorzy:
Mazerski, J.
Powiązania:
https://bibliotekanauki.pl/articles/1965824.pdf
Data publikacji:
2001
Wydawca:
Politechnika Gdańska
Tematy:
molecular modelling
free energy of binding
intercalation into DNA
linear responce method
free energy perturbation method
Opis:
The computer modelling and simulation methods are widely used in rational drug design to obtain information necessary for understanding interactions between a ligand (drug molecule) and its cellular macromolecular target on molecular level. The determination of free energies of binding for ligand-target complexes is one of the crucial points in those studies. In recent years several methods have been proposed to solve this problem. The majority of them use molecular dynamics (MD) simulations. Two, most popular methods: (i) a free energy perturbation method (FEP), and (ii) a linear response (LR) method, are shortly presented in this paper together with their limitations and advantages. In this work I presented the first attempt to use LR approach to 10 anti-tumour agents able to intercalate into DNA. The LR relationship obtained in the present study indicated that in the system studied the electrostatic term has no influence on the free energy of binding. The relationship is now successfully used in our research group in further molecular modelling studies concerning DNA intercalators with similar structure.
Źródło:
TASK Quarterly. Scientific Bulletin of Academic Computer Centre in Gdansk; 2001, 5, 3; 301-310
1428-6394
Pojawia się w:
TASK Quarterly. Scientific Bulletin of Academic Computer Centre in Gdansk
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Conformational Ensemble of B Chain in $T_{6}$ Human Insulin Based on the Landau Free Energy
Autorzy:
Lei, Yanlin
He, Jianfeng
Liu, Jiaojiao
Li, Jing
Powiązania:
https://bibliotekanauki.pl/articles/1398189.pdf
Data publikacji:
2018-05
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
insulin
structural flexibility
free energy
conformational ensemble
Opis:
Insulin is an important peptide hormone for the glucose metabolism. The structural flexibility of insulin B chain attracts a lot of our attention for understanding the biological activity. Our work carried out the extensive sampling to statistically clarify the structural changes of isolated $T_{6}$ human insulin B chain. We introduced the Landau free energy to describe the isolated insulin B chain whose experimental structure locates a local energy minimum. Its trained model was subjected to thousands of heating and cooling circles between the high and low temperatures. Six typical structure clusters were found by classifying the final generated structures with RMSD and radius of gyration. The structures in clusters indicate the potential deformations of insulin B chain at residues 5-8 of N-terminus, residues 9-12 of central helix and residues 24-29 of C-terminus, which agrees with the experimental results.
Źródło:
Acta Physica Polonica A; 2018, 133, 5; 1261-1265
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Application of the Ozonation Process for Shaping the Energy Properties of the Surface Layer of Polymer Construction Materials
Autorzy:
Kłonica, Mariusz
Powiązania:
https://bibliotekanauki.pl/articles/2027827.pdf
Data publikacji:
2022
Wydawca:
Polskie Towarzystwo Inżynierii Ekologicznej
Tematy:
surface layer
ozone
polymer material
surface free energy
Opis:
The properties of the surface layer of construction materials are very important for making adhesive bonds. The article presents the test results for surface free energy in PA6 polyamide subjected to surface layer modification using the ozonation process. To develop the surface geometrically, the samples were subjected to mechanical processing. The comparison of results demonstrated that ozonation is an efficient and eco-friendly method of modifying the surface layer. The article also presents the comparison results for measurements of selected surface roughness parameters.
Źródło:
Journal of Ecological Engineering; 2022, 23, 2; 212-219
2299-8993
Pojawia się w:
Journal of Ecological Engineering
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Mechanism and Synthesis of Yttrium Iron (Y-Fe) Alloy by Low Temperature Process Using Calcium as Reductant
Autorzy:
Ilayaraja, Marimuthu
Berchmans, L. John
Sankaranarayan, Sankara Raman
Powiązania:
https://bibliotekanauki.pl/articles/355144.pdf
Data publikacji:
2019
Wydawca:
Polska Akademia Nauk. Czytelnia Czasopism PAN
Tematy:
Gibbs free energy
reaction kinetics
VSM
XRD
SEM
Opis:
In this paper, study the preparation of Y-Fe alloy by reduction-diffusion process, which is novel technique for producing an alloy from its ores directly at different temperatures. From this work, investigates the particles size and morphology structure of alloy by X-Ray Diffraction (XRD), Energy dispersive-X-ray analyzer (EDAX) and Scanning Electron Microscope (SEM) respectively. Here study the thermodynamics of property of system such as Gibbs free energy and reaction kinetics of system respectively. The Vibrating Sample magnetometer (VSM) is used to study the magnetic properties of alloy such as cocerviety, saturation magnetization and retentivity.
Źródło:
Archives of Metallurgy and Materials; 2019, 64, 4; 1593-1596
1733-3490
Pojawia się w:
Archives of Metallurgy and Materials
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Analysis of oxygen binding by hemoglobin on the basis of mean intrinsic thermodynamic quantities
Autorzy:
Bordbar, Abdol-Khalegh
Mousavi, Sayed
Dazhampanah, Hamid
Powiązania:
https://bibliotekanauki.pl/articles/1041216.pdf
Data publikacji:
2006
Wydawca:
Polskie Towarzystwo Biochemiczne
Tematy:
cooperativity
mean intrinsic Gibbs free energy
linkage phenomena
hemoglobin
Opis:
The binding data for oxygenation of human hemoglobin, Hb, at various temperatures and in the absence and presence of 2,3-diphosphoglycerate, DPG, and inositol hexakis phosphate, IHP, were analyzed for extraction of mean intrinsic Gibbs free energy, ΔGo, enthalpy, ΔHo, and entropy, ΔSo, of binding at various partial oxygen pressures. This method of analysis considers all the protein species present such as dimer and tetramer forms which were not considered by Imai et al. (Imai K et al., 1970, Biochim Biophys Acta 200: 189 - 196) , in their analysis which was based on Adair equation. In this regard, the values of Hill equation parameters were estimated with high precision at all points of the binding curve and used for calculation of ΔGo, ΔHo and ΔSo were also calculated by analysis of ΔGo values at various temperatures using van't Hoff equation. The results represent the enthalpic nature of the cooperativity in Hb oxygenation and the compensation effect of intrinsic entropy. The interpretation of results also to be, into account the decrease of the binding affinity of sites for oxygen in the presence of DPG and IHP without any considerable changes in the site - site interaction (extent of cooperativity). In other words, the interactions between bound ligands, organic phosphates and oxygen, are more due to a decreasing binding affinity and not to the reduction of the cooperative interaction between sites. The results also document the more heterotropic effect of IHP compared to DPG.
Źródło:
Acta Biochimica Polonica; 2006, 53, 3; 563-568
0001-527X
Pojawia się w:
Acta Biochimica Polonica
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Adsorption behavior of surfactants on lignite particles with different densities in aqueous medium
Autorzy:
Wang, J.
He, Y.
Wen, B.
Ling, X.
Xie, W.
Wang, S.
Powiązania:
https://bibliotekanauki.pl/articles/110538.pdf
Data publikacji:
2017
Wydawca:
Politechnika Wrocławska. Oficyna Wydawnicza Politechniki Wrocławskiej
Tematy:
interfacial surface free energy
adsorption
lignite
surfactant
Washburn equation
Opis:
Lignite is well known for its strong hydrophilicity and hard-to-float properties. However, the surface free energy of the solid is made up of two components, that is the Lifshitz-van der Waals and acid-base interaction energy. Differences in these two components between the low ash (lower density) and high ash fraction (higher density) provide a benefit for improving the separation efficiency through introducing surfactants in flotation. In this paper, thermodynamic characterization of three density lignite fractions was measured by a Washburn dynamic method. Combining the Washburn equation and Van Oss-Chaudhury-Good theory, the surface free energy components of three samples were calculated according to the wetting process by n-hexane, diiodomethane, deionized water and ethylene glycol. The Lifshitz-van der Waals part of surface free energy reduced with the coal density increase, especially between fractions of -1.45 g/cm3 and 1.45-1.80 g/cm3, while the Lewis base part increased slightly. The interfacial interaction free energies between the surfactant and lignite in aqueous medium indicated that the low hydrophilic index benefited for the stronger adsorption intensity. Increase of the surfactant Lifshitz-van der Waals component increases the adsorptive intensity on lower density lignite and the repulsive intensity on higher density lignite, which is beneficial for separation.
Źródło:
Physicochemical Problems of Mineral Processing; 2017, 53, 2; 996-1008
1643-1049
2084-4735
Pojawia się w:
Physicochemical Problems of Mineral Processing
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Control of glass surface wettability via esterification with n-alkyl alcohols
Autorzy:
Kruszelnicki, Mateusz
Polowczyk, Izabela
Kowalczuk, Przemyslaw B.
Powiązania:
https://bibliotekanauki.pl/articles/2146948.pdf
Data publikacji:
2022
Wydawca:
Politechnika Wrocławska. Oficyna Wydawnicza Politechniki Wrocławskiej
Tematy:
hydrophobicity
surface free energy
contact angle
zeta potential
roughness
Opis:
Surface wettability plays an essential role in many processes and materials applications. It depends mainly on the surface roughness and chemical composition, thus through a controlled modification of these parameters, the wettability can be restrained. Glass is an inorganic solid material, composed mainly of amorphous silica, which surface, due to the presence of reactive hydroxyl groups, can be quite easily chemically modified. This feature can be used to control the wettability of glass by reaction with organic compounds. In this study, the esterification of glass silanol groups with n-alkyl alcohols (Cn/H2n+1/OH, n=3, 4, 6, 8, 10) was employed to modify its wettability. The effect of such modification on the physicochemical properties of glass surface was comprehensively investigated and characterised by the water contact angle, surface free energy, zeta potential, atomic force microscopy (AFM) and X-ray photoelectron spectroscopy (XPS) measurements. We demonstrate that the wettability of the esterified glass surface is strongly dependent on both the chain length of used alcohol and modification time. The alcohol molecule binds to the glass surface through a Si-O-C bond, leading to the formation of a monolayer that does not significantly affect the surface morphology and zeta potential. Conducted studies provided a broader view of the influence of this technique for modifying surface wettability on its physicochemical properties.
Źródło:
Physicochemical Problems of Mineral Processing; 2022, 58, 2; art. no. 145147
1643-1049
2084-4735
Pojawia się w:
Physicochemical Problems of Mineral Processing
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Microstructure and surface free energy of light-cured dental composites after their modification with liquid rubber
Autorzy:
Sowa, Monika
Przekora, Agata
Pałka, Krzysztof
Powiązania:
https://bibliotekanauki.pl/articles/2058402.pdf
Data publikacji:
2022
Wydawca:
Akademia Górniczo-Hutnicza im. Stanisława Staszica w Krakowie. Polskie Towarzystwo Biominerałów
Tematy:
dental composite
solubility
liquid rubber
wettability
surface free energy
Opis:
The use of liquid rubber as a component of light-cured dental composites is one of the methods of increasing their fracture toughness. It also reduces polymerization shrinkage and offers the potential to lower water sorption. The aim of the study was to evaluate the miscibility of liquid rubber in composite matrix resins as well as changes in the wettability and surface free energy (SFE) values of commercial lightcuring composites after their modification with liquid rubber. The research materials were Flow Art and Boston (Arkona) light-cured composites and resin mixtures used in their production. Liquid rubber Hypro 2000X168LC VTB (Huntsman Int.) was used as a modifier. The solubility of liquid rubber was assessed under light microscopy. The contact angle and SFE measurements were made on a DSA30 goniometer (Kruss) using water and diiodomethane. It was found that the liquid rubber solubility depended mainly on the viscosity of the resin, which was related to the amount of BisGMA. The resulting mixture showed good temporal stability without larger domains. The curing process released the liquid rubber as a separate phase formed as spherical domains. The morphology of these domains was homogeneous and their size did not exceed 50 µm in diameter. The presence of liquid rubber in modified composites increased their hydrophobicity and reduced the surface free energy value. The obtained properties might help to reduce the formation of bacterial biofilm on dental fillings.
Źródło:
Engineering of Biomaterials; 2022, 25, 164; 9--15
1429-7248
Pojawia się w:
Engineering of Biomaterials
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Wettability of hybrid chitosan/phospholipid coatings
Autorzy:
Jurak, Małgorzata
Wiącek, Agnieszka E
Powiązania:
https://bibliotekanauki.pl/articles/1034545.pdf
Data publikacji:
2017
Wydawca:
Sieć Badawcza Łukasiewicz - Polskie Towarzystwo Chitynowe
Tematy:
chitosan/phospholipid films
contact angle hysteresis
surface free energy
Opis:
Solution spreading and Langmuir-Blodgett/Schaefer techniques were used for preparation of chitosan/phospholipid (DPPC) films on air plasma treated polyethylene terephthalate (PET) plates. The surface wetting properties were determined based on the measurements of the advancing and receding contact angles of water, formamide and diiodomethane. The contact angle hysteresis model of Chibowski was applied to estimate the total surface free energy values. The coatings properties were found to be affected by molecular organisation and packing depending on the preparation technique. Phospholipid molecules modified the chitosan film surface by changing the kind and magnitude of interactions, which is revealed in the values of surface free energy. These findings may be helpful for the development of new generation polymer-supported biocompatible coatings with anti-thrombogenic and anti-bactericidal properties, thus expanding the spectrum of chitosan applications.
Źródło:
Progress on Chemistry and Application of Chitin and its Derivatives; 2017, 22; 66-76
1896-5644
Pojawia się w:
Progress on Chemistry and Application of Chitin and its Derivatives
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Key factors governing fibril formation of proteins: insights from simulations and experiments
Autorzy:
Co, N. T.
Viet, M. H.
Truong, P. M.
Kouza, M.
Li, M. S.
Powiązania:
https://bibliotekanauki.pl/articles/1954243.pdf
Data publikacji:
2022-02-01
Wydawca:
Politechnika Gdańska
Tematy:
tworzenie włókienek
swobodna energia wiązania
fibre formation
binding free energy
Opis:
Fibril formation of proteins and peptides is associated with a large group of major human diseases, including Alzheimer’s disease, prion disorders, amyotrophic lateral sclerosis, type 2 diabetes, etc. Therefore, understanding the key factors that govern this process is of paramount importance. The fibrillogenesis of polypeptide chains depends on their intrinsic properties as well as on the external conditions. In this mini-review we discuss the relationship between fibril formation kinetics and the sequence, aromaticity, hydrophobicity, charge and population of the so called fibril-prone conformation in a monomer state. The higher the population, the faster is the fibril elongation and this dependence may be described by a single exponential function. This observation opens up a new way to understand the fibrillogenesis of bio-molecules at the monomer level. We will also discuss the influence of the environment with focus on the recently observed dual effect of crowders on the aggregation rat es of polypeptide chains.
Źródło:
TASK Quarterly. Scientific Bulletin of Academic Computer Centre in Gdansk; 2014, 18, 3; 245--254
1428-6394
Pojawia się w:
TASK Quarterly. Scientific Bulletin of Academic Computer Centre in Gdansk
Dostawca treści:
Biblioteka Nauki
Artykuł
Wyświetlanie 1-15 z 97

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