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Browsing by Subject "physical chemistry"

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    • Article  

      A novel QSPR model for predicting θ (lower critical solution temperature) in polymer solutions using molecular descriptors 

      Melagraki, G.; Afantitis, Antreas; Sarimveis, H.; Koutentis, Panayiotis Andreas; Markopoulos, J.; Igglessi-Markopoulou, O. (2007)
      In this study, we present a new model that has been developed for the prediction of θ, (lower critical solution temperature) using a database of 169 data points that include 12 polymers and 67 solvents. For the characterization ...

    • Article  

      Activated biochar derived from cactus fibres - Preparation, characterization and application on Cu(II) removal from aqueous solutions 

      Hadjittofi, Loukia; Prodromou, Melpomeni; Pashalidis, Ioannis (2014)
      The adsorption efficiency of activated biochar prepared from cactus fibres regarding the removal of Cu(II) from aqueous solutions has been investigated as a function of various physicochemical parameters (e.g. pH, initial ...

    • Article  

      Americium and samarium determination in aqueous solutions after separation by cation-exchange 

      Kiliari, T.; Pashalidis, Ioannis (2014)
      The concentration of trivalent americium and samarium in aqueous samples has been determined by means of alpha-radiometry and UV-Vis photometry, respectively, after chemical separation and pre-concentration of the elements ...

    • Article  

      Authenticity of the traditional Cypriot spirit "zivania" on the basis of 1H NMR spectroscopy diagnostic parameters and statistical analysis 

      Petrakis, Panos V.; Touris, Ioannis; Liouni, Maria; Zervou, Maria; Kyrikou, Ioanna; Kokkinofta, Rebecca I.; Theocharis, Charis R.; Mavromoustakos, Thomas M. (2005)
      A previous publication (Kokkinofta et al. J. Agric. Food Chem. 2003, 51, 6233-6239) discussed the use of inductively coupled plasma spectroscopy to differentiate between the traditional Cypriot alcoholic beverage zivania ...

    • Article  

      Catalytic oxidation of N -phenylamidrazones to 1,3-Diphenyl-1,4-dihydro-1, 2,4-benzotriazin-4-yls: An improved synthesis of blatters radical 

      Koutentis, Panayiotis Andreas; Lo Re, D. (2010)
      Blatters radical, 1,3-diphenyl-1,4-dihydro-1,2,4-benzotriazin-4-yl (1a, R =H), and several of its C-7 substituted analogues (R =CF3, Cl, Br, I, Me, OMe) were prepared in good-to-excellent yields through catalytic oxidation ...

    • Article  

      Development and evaluation of a QSPR model for the prediction of diamagnetic susceptibility 

      Afantitis, Antreas; Melagraki, G.; Sarimveis, H.; Koutentis, Panayiotis Andreas; Markopoulos, J.; Igglessi-Markopoulou, O. (2008)
      A novel QSPR model is developed and evaluated for the prediction of diamagnetic susceptibility. The model was produced using the Multiple Linear Regression (MLR) technique on a database that consists of 406 organic compounds ...

    • Article  

      Drug delivery innovations for enhancing the anticancer potential of vitamin e isoforms and their derivatives 

      Neophytou, Christiana M.; Constantinou, Andreas I. (2015)
      Vitamin E isoforms have been extensively studied for their anticancer properties. Novel drug delivery systems (DDS) that include liposomes, nanoparticles, and micelles are actively being developed to improve Vitamin E ...

    • Article  

      The effect of aging and natural organic matter on the Th(OH)4 solubility 

      Prodromou, Melpomeni; Antoniou, Stella; Pashalidis, Ioannis (2014)
      The solution chemistry of actinides, particularly hydrolysis, is of major importance in the design of nuclear waste repositories and in relation to nuclear fuel reprocessing cycles. In this study the formation and solubility ...

    • Article  

      The effect of physicochemical parameters on the separation recovery of plutonium and uranium from aqueous solutions by cation exchange 

      Kiliari, T.; Pashalidis, Ioannis (2010)
      The effect of physicochemical parameters such as pH, salinity (e.g. [NaCl]) and competitive cation (e.g. Ca 2+ and Fe 3+) concentration on the separation recovery of plutonium and uranium from aqueous solutions by cation ...

    • Article  

      EPR-effect: Utilizing size-dependent nanoparticle delivery to solid tumors 

      Stylianopoulos, T. (2013)

    • Article  

      Experimental and theoretical studies on physico-chemical parameters affecting the solubility of phosphogypsum 

      Papanicolaou, F.; Antoniou, Stella; Pashalidis, Ioannis (2009)
      Phosphogypsum is a waste by-product of the phosphate fertilizer industry, which is usually disposed in the environment because of its restricted use in industrial applications. Physico-chemical conditions existing in stack ...

    • Article  

      Hofmeister anion effects on surfactant self-assembly and the formation of mesoporous solids 

      Leontidis, Epameinondas (2002)
      Recent work on mesoporous silica formation using cationic and non-ionic templates has unveiled a large number of anion effects. Anions are seen to change the hydrolysis rates of the silicate precursors, affecting the surface ...

    • Article  

      Molecular Dynamics in Drug Design: New Generations of Compstatin Analogs 

      Tamamis, Phanourios; López de Victoria, A.; Gorham, R. D.; Bellows-Peterson, M. L.; Pierou, P.; Floudas, C. A.; Morikis, D.; Archontis, Georgios Z. (2012)
      We report the computational and rational design of new generations of potential peptide-based inhibitors of the complement protein C3 from the compstatin family. The binding efficacy of the peptides is tested by extensive ...

    • Article  

      A novel QSAR model for evaluating and predicting the inhibition activity of dipeptidyl aspartyl fluoromethylketones 

      Afantitis, Antreas; Melagraki, G.; Sarimveis, H.; Koutentis, Panayiotis Andreas; Markopoulos, J.; Igglessi-Markopoulou, O. (2006)
      A linear quantitative structure activity relationship model is obtained using Multiple Linear Regression (MLR) analysis as applied to a series of 49 dipeptidyl aspartyl fluoromethylketone derivatives with inhibitory activity ...

    • Article  

      A novel QSAR model for predicting induction of apoptosis by 4-aryl-4H-chromenes 

      Afantitis, Antreas; Melagraki, G.; Sarimveis, H.; Koutentis, Panayiotis Andreas; Markopoulos, J.; Igglessi-Markopoulou, O. (2006)
      A linear quantitative structure-activity relationship (QSAR) model is presented for modeling and predicting induction of apoptosis by 4-aryl-4H-chromenes. The model was produced by using the multiple linear regression (MLR) ...

    • Article  

      Prediction of blood:air and fat:Air partition coefficients of volatile organic compounds for the interpretation of data in breath gas analysis 

      Kramer, C.; Mochalski, Paweł; Unterkofler, K.; Agapiou, Agapios; Ruzsanyi, V.; Liedl, K. R. (2016)
      In this article, a database of blood:air and fat:air partition coefficients (λ b:a and λ f:a) is reported for estimating 1678 volatile organic compounds recently reported to appear in the volatilome of the healthy human. ...

    • Article  

      Predictive QSAR workflow for the in silico identification and screening of novel HDAC inhibitors 

      Melagraki, G.; Afantitis, Antreas; Sarimveis, H.; Koutentis, Panayiotis Andreas; Kollias, G.; Igglessi-Markopoulou, O. (2009)
      A linear Quantitative Structure-Activity Relationship (QSAR) is developed in this work for modeling and predicting HDAC inhibition by 5-pyridin-2-yl- thiophene-2-hydroxamic acids. In particular, a five-variable model is ...

    • Article  

      Spectral density ratio based clustering methods for the binary segmentation of protein sequences: A comparative study 

      Ioannou, Androulla; Fokianos, Konstantinos; Promponas, Vasilis J. (2010)
      We compare several spectral domain based clustering methods for partitioning protein sequence data. The main instrument for this exercise is the spectral density ratio model, which specifies that the logarithmic ratio of ...

    • Article  

      Structural, magnetic, electronic, and spin transport properties of epitaxial Fe 3Si/GaAs(001) 

      Ionescu, A.; Vaz, C. A. F.; Trypiniotis, Theodossis; Gürtler, C. M.; García-Miquel, H.; Bland, J. A. C.; Vickers, M. E.; Dalgliesh, R. M.; Langridge, S.; Bugoslavsky, Y.; Miyoshi, Y.; Cohen, L. F.; Ziebeck, K. R. A. (2005)
      We report experimental results on the structural, magnetic, electronic, and spin transport properties of a 21 nm Fe 3Si/GaAs(001) heterostructure epitaxially grown by coevaporation. High-resolution x-ray diffraction shows ...

    • Article  

      Synthesis of [(4-Chloro-5H-1,2,3-dithiazol-5-ylidene)amino]azines 

      Koutentis, Panayiotis Andreas; Koyioni, Maria G.; Michaelidou, Sophia S. (2011)
      The reactions of 2-, 3- and 4-aminopyridines with 4,5-dichloro-1,2,3- dithiazolium chloride (Appel salt) 4 to give N-(4-chloro-5H-1,2,3-dithiazol-5- ylidene)pyridin-Xamines 1a (X = 2), 1g (X = 3) and 1k (X = 4) were optimized ...

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