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A Practical Computational Approach to Study Molecular Instability Using the Pseudo-Jahn-Teller Effect
(American Chemical Society (ACS), 2014)
Vibronic coupling theory shows that the cause for spontaneous instability in systems presenting a nondegenerate ground state is the so-called pseudo-Jahn-Teller effect, and thus its study can be extremely helpful to ...
Mononuclear silver(I) complexes with 1,7-phenanthroline as potent inhibitors of Candida growth
(Elsevier France-Editions Scientifiques Medicales Elsevier, Issy-Les-Moulineaux, 2018)
Mononuclear silver(I) complexes with 1,7-phenanthroline (1,7-phen), [Ag(NO3-O,O') (1,7-phen-N7)(2)] (1) and [Ag(1,7-phen-N7)(2)]X, X = ClO4- (2), CF3SO3- (3), BF4- (4) and SbF6- (5) were synthesized and structurally ...
Covalent binding of food-derived blue pigment phycocyanobilin to bovine beta-lactoglobulin under physiological conditions
(Elsevier Sci Ltd, Oxford, 2018)
In this study, we investigated structural aspects of covalent binding of food derived blue pigment phycocyanobilin (PCB) to bovine beta-lactoglobulin (BLG), major whey protein, by spectroscopic, electrophoretic, mass ...
Theoretical study of the magnetic anisotropy and magnetic tunnelling in mononuclear Ni(II) complexes with potential molecular magnet behavior
(Royal Soc Chemistry, Cambridge, 2014)
Magnetic molecules that present a slow decay of their magnetization (molecular magnets) are very interesting both from a fundamental and applied points of view. While many approaches focus strongly on finding systems with ...
3D electrogenerated chemiluminescence: from surface-confined reactions to bulk emission
(Royal Soc Chemistry, Cambridge, 2015)
Among luminescence techniques, electrogenerated chemiluminescence (ECL) provides a unique level of manipulation of the luminescent process by controlling the electrochemical trigger. Despite its attractiveness, ECL is by ...
Nanophotonic design of perovskite/silicon tandem solar cells
(Royal Society of Chemistry, 2018)
The perovskite material system allows for the realization of perovskite/silicon tandem solar cells with high energy conversion efficiencies at low cost. To realize such solar cells, the device geometry, the device processing, ...
Capillary rise and sorption ability of hemp fibers oxidized by non-selective oxidative agents: hydrogen peroxide and potassium permanganate
(USA :Taylor & Francis INC, 2021)
In this paper, the capillary rise and sorption ability of hemp fibers oxidized with hydrogen peroxide and potassium permanganate were studied, with the aim to get more insight into the changes in the structure of hemp ...
Calcium oxide as a promising heterogeneous catalyst for biodiesel production: Current state and perspectives
(Oxford : Pergamon-Elsevier Science Ltd, 2016)
The present paper is an overview of the recent progress in the development of various CaO-based catalysts suitable for biodiesel production. The mechanism, kinetics and optimization of transesterification reaction over ...
Physico-chemical evaluation of hydrophobically modified pectin derivatives: Step toward application
(Elsevier, 2018)
Present study reports synthesis and physico-chemical evaluation of hydrophobically modified pectin derivatives, obtained by reacting of pectin with di-acyl chlorides (glutaryl and sebacoyl chloride). Depending on length ...
Conformational stability of digestion-resistant peptides of peanut conglutins reveals the molecular basis of their allergenicity
(Nature Publishing Group, London, 2016)
Conglutins represent the major peanut allergens and are renowned for their resistance to gastrointestinal digestion. Our aim was to characterize the digestion-resistant peptides (DRPs) of conglutins by biochemical and ...