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Приказ резултата 21-30 од 154
Pesticides in Topsoil Level of Agricultural Soil
(Pilares D'Elegancia, Lda, 2022)
The aim of this study was to monitor the presence of more of almost 280 pesticides in the topsoil level of agricultural soil in Serbia.
A Glimpse into the Ligand Field Theory from Density Functional Perspective
(Univ. Nova de LisboaCOST Action CM1305, 2017)
Electronic structure of transition metal complexes are commonly rationalized within the Ligand Field Theory (LFT). In LFT the Hamiltonian is parameterized in terms of one-electron (LF) parameters and two-electron repulsion ...
Clofazimine acid-base solubilization: influence of small organic acids’ concentration
(International Association of Physical Chemists, 2023)
Methods for drug solubilization have become important part of modern drug discovery and
development due to increasing number of extremely insoluble drugs and drug candidates.
One of such methods is acid-base ...
Rational design of single molecule magnets
(World Association of Theoretical and Computational Chemists, 2017)
In this work, computational study of the magnetic anisotropy in series of transition metal complexes when changing the metal ion or the ligands in a controlled way will be presented. In order to achieve this goal, first, ...
Highly active endo-pectinases from Aspergillus tubingensis: A novel enzyme for fruit processing
(Serbian Chemical Society, 2023)
Pectinases are a type of enzymes frequently used in the food industry to clarify, liquefy, and stabilize fruit juices. The main challenge in fruit juice production is the cloudiness of the juice, which is largely caused ...
Self-discriminating assembly and biorecognition of a spirohydantoin derived from α-tetralone
(COST Action CA21101 "COSY", 2023)
The hierarchical development of the crystal structure of racemic 3-(4-methoxybenzyl)-6,7- benzo-1,3-diazaspiro[4.5]decane-2,4-dione was analyzed through cooperativity of various homo and heterochiral dimeric motifs ...
Revealing Self-organization of Granular Matter: From Fundamental Physics to Military Technology Applications
(Belgian Physical Society, 2023)
Besides fundamental importance, granular physics has made considerable progress in revealing the dynamics of large ensembles of interacting macroscopic particles and their pattern formation for various applications in ...
Revealing non-equilibrium dynamics by holography: The case of Briggs-Rauscher reaction
(Belgrade : Vinča Institute of Nuclear Sciences, 2023)
In this study, the interferometric (holographic) approach is used to unveil the dynamics of the phase transition, e.g., the formation of solid iodine in the Briggs-Rauscher (BR) non-equilibrium system. Subsequently, after ...
DFT/Solvation Continuum Electrostatic Calculations of Proton Pumping in Mammalian Cytochrome c Oxidase
(COST Action CA21101 "COSY", 2023)
With computer simulations that assess pKas of critical residues, explore electron and proton pathways, and evaluate the energetics of PT and ET processes, we can provide a more in-depth understanding of the molecular ...
Monitoring the Formation of Oxygen Bubble Patterns as a Forecast for Reaction Dynamics
(Belgian Physical Society, 2023)
A non-equilibrium process, i.e., the state I (low concentration of iodide and iodine) to the state II (high concentration of iodide and iodine) transition, occurring after oscillatory Briggs-Rauscher reaction, was monitored ...