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Treatment of the Multimode Jahn-Teller Problem in Small Aromatic Radicals
(American Chemical Society (ACS), 2011)
The family of the Jahn-Teller (JT) active hydrocarbon rings, CH (n = 5-7), was analyzed by the means of multideterminantal density functional theory (DFT) approach. The multimode problem was addressed using the intrinsic ...
The most important bioactive components of cold pressed oil from different pumpkin (Cucurbita pepo L.) seeds
(Elsevier, 2014)
The composition and content of certain bioactive components of the cold pressed oil obtained from six samples of pumpkin seeds (Cucurbita pepo L.) cultivated in Serbia were analyzed by GC and GC/MS. The composition and ...
Morphological and chemical characterization of Arnica montana L. under different cultivation models
(Elsevier, 2014)
Arnica (Arnica montana L) is a perennial mountain plant whose flower heads are mainly used for topical treatment of bruises and sprains in phytopharmaceutical preparations such as ointments, creams and gels. In this study, ...
Effect of surface modified TiO2 nanoparticles on thermal, barrier and mechanical properties of long oil alkyd resin-based coatings
(Budapest University of Technology, 2015)
Novel soy alkyd-based nanocomposites (NCs) were prepared using TiO2 nanoparticles (NPs) surface modified with different gallates, and for the first time with imine obtained from 3,4-dihydroxybenzaldehyde and oleylamine ...
Preferred Geometries and Energies of Sulfur Sulfur Interactions in Crystal Structures
(American Chemical Society (ACS), 2016)
It has been demonstrated that sulfur sulfur interactions can exist in various molecular systems. In this work we investigated sulfur-sulfur interactions in crystal structures of small molecules by analyzing geometric data ...
Effect of sepiolite organomodification on the performance of PCL/sepiolite nanocomposites
(Oxford : Pergamon-Elsevier Science Ltd, 2017)
Poly(epsilon-caprolactone) (PCL) based nanocomposites with unmodified and organomodified sepiolites were prepared by solution casting method. The sepiolites were modified with short (3-mercaptopropyl)trimethoxysilane ...
CH/pi interactions in metal-porphyrin complexes with pyrrole and chelate rings as hydrogen acceptors
(Elsevier Science Inc, New York, 2012)
CH/pi interactions in metal porphyrinato complexes were studied by analyzing data in crystal structures from the Cambridge Structural Database (CSD) and by quantum chemical calculations. The analysis of the data in the CSD ...
in/out Isomerism of cyclophanes: a theoretical account of 2,6,15-trithia-[3(4,10)][7]metacyclophane and [3(4,10)][7]metacyclophane as well as their halogen substituted analogues
(Royal Soc Chemistry, Cambridge, 2017)
A detailed theoretical investigation of cyclophanes with a divergent set of methods ranging from molecular mechanics through semiempirical to ab initio is presented. Cyclophanes have attracted interest over the years due ...
Advances in mathematical modelling of the hypothalamic-pituitary-adrenal (HPA) axis dynamics and the neuroendocrine response to stress
(Elsevier Sci Ltd, Oxford, 2018)
Stress is a physiological reaction of an organism to a demand for change that is imposed by external factors or is coming from within by way of physiological strains or self-perceived mental and/or emotional threats (internal ...
Isolation, Characterization, and In Vitro Cytotoxicity of New Sesquiterpenoids from Achillea clavennae
(Georg Thieme Verlag Kg, Stuttgart, 2014)
Further phytochemical investigation of the aerial parts of Achillea clavennae has resulted in the isolation of three new sesquiterpene lactones: two highly oxygenated germacranolides (1, 2) and the iso-seco-guaianolide ...