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How minor structural changes generate major consequences in photophysical properties of RE coordination compounds;resonance effect,lMCT state

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Journal of Rare Earths 2020年第5期38卷 552-563页

作者： Ewa Kasprzycka Albano N.Carneiro Neto Viktor A.Trush lucjan Jerzykiewicz Vladimir M.Amirkhanov Oscar l.Malta janina l.gendziewicz Paula Gawryszewska University of Applied Sciences-Fachhochschule Münster Department of ChemicalEngineeringStegerwaldstr.39Steinjurt48565Germany Physics Department and CICECO-Aveiro Institute of Materials University of Aveiro38 JO-193AveiroPortugal Department o f Chemistry Taras Shevchenko National University of Kyivul.Volodymyrska 64Kyiv01601 Ukraine Faculty of Chemistry University of Wroclaw14 F.Joliot-Curie Street50-383WroclawPoland Departamento de Quimica Fundamental Universidade Federal de Pernambuco Cidade Universitaria RecifePE50740-560Brazil

lanthanide coordination compounds of the formula Na[ln(l)4](1 ln),where ln=la^3+,Eu^3+,Gd^3+,Tb^3+,l=[l]-and Hl=dimethyl(4-methylphenylsulfo nyl)amidophosphate,were *** structural and spectro scopic properties were discussed in detail based on X-ray diffraction measurements,IR spectroscopy,absorption and emission spectroscopy at 293 and 77 K and theoretical calculations of the intramolecular energy transfer(IET)*** calculations were used to investigate the 1 ln electronic properties re quired to calculate the transition rates.30 and 22 pathways of intramolecular nonradiative energy transfer were examined in the case of 1 Eu and 1 Tb,*** is shown that the main pathway for sensitization of the lanthanide emission is either the triplet(1 Eu)or singlet(1 Tb)transfer,occurring mainly through the exchange *** energy rates for energy transfer from S1 and T1 equal WS=1.53×10^5 s^-1(1 Eu),WT=5.14×10^6 s^-1(1 Eu)and WS=4.09×10^7 s^-1(1 Tb),WT=6.88×10^5 s^-1(1 Tb).The crucial role of the 7 F5 level in the energy transfer process of 1 Tb and the participation of the lMCT state in the depopulation of the ligand singlet state of 1 Eu were *** influence of the resonance effect on the splitting of the7 F1 level in 1 Eu was *** comparing the properties of 1 ln with the properties of 2 ln coordination compounds,sharing the same ligand and crystallizing in the same crystallographic system(monoclinic),but with a different space group,it is demonstrated how slight structural changes can affect the photophysical properties of ln compounds.

关键词： lanthanide Phosphorylated sulfonamides Energy transfer Antenna effect Crystal structure Resonance effect

Stabilization of Magnetite Nanoparticles by Encapsulation into the Silica Matrix

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Journal of Chemistry and Chemical Engineering 2014年第1期8卷 42-46页

作者： Alona Gabrene janina Setina Inna Juhnevica Gundars Mezinskis Institute of Silicate Materials Faculty of Materials Science and Applied Chemistry Riga Technical University Riga L V-104 Latvia

Different methods have been investigated for the synthesis of magnetic nanoparticles. Control of the particle size, dispersion, purity and stability have been always regarded an issue. In this study magnetite （Fe304） superparamagnetic nanoparticles with a size range about 20 nm have been successfully synthesized using chemical co-precipitation method from the solution of ferrous/ferric mixed salt-solution in alkaline media in oxygen-free environment. The sol-gel method has been chose to encapsulate magnetic nanoparticles into silica matrix. The phase structures, morphologies, surface area, functional classes and magnetic properties have been characterized by X-ray diffraction, SEM and AFM, BET, FT-IR and VSM. The results showed that the resultant films, consisting of encapsulated magnetite have crack free and smooth surface with a roughness value 1.5 rim.

关键词： Magnetite silica matrix nanoparticles encapsulation thin film.

Spider odors induce stoichiometric changes in fruit fly Drosophila melanogaster

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Current Zoology 2021年第1期67卷 127-129页

作者： Ronalds KRAMS Tatjana KRAMA Maris MUNKEVICS Sarah EICHlER David M.BUTlER linda DOBKEVICA Priit JOERS Jorge CONTRERAS-GARDUNO janina DAUKSTE Indrikis A.KRAMS Plant Health Estonian University of Life SciencesTartu 51006Estonia Department of Biotechnology Daugavpils UniversityDaugavpils 5401Latvia Institute of Ecology and Earth Sciences University of TartuTartu 51010Estonia Department of Zoology and Animal Ecology Faculty of BiologyUniversity of LatviaRiga 1004Latvia Department of Biological Sciences Kent State UniversityOhioSalem 4460USA Department of Plant Sciences University of TennesseeKnoxville 37996-4561USA Department of Environmental Science Faculty of Geography and Earth SciencesUniversity of LatviaRiga 1004Latvia Department of General and Microbial Biochemistry University of TartuTartu 51010Estonia Escuela Nacional de Estudios Superiores Unidad Morelia Universidad Nacional Autonoma de MexicoMorelia 58190Mexico Institute of Food Safety Animal Health and Environment BIORRiga 1076Latvia Department of Psychology University of TennesseeKnoxville 37996-4561USA

Animal senses and signals are amazingly diverse,and the major modalities by which animals acquire sensory input from their environments are sound,light,vibration,and chemical *** mainly rely on visual,nociceptive,and olfactory cues to discriminate between rewards and *** has been shown that the visual and olfactory cues of predators substantially affect the adult phenotype in Drosophila melanogaster(Krams et al.2016),a prominent animal model for biological research.

关键词： melanogaster cues Drosophila

finDr:A web server for in silico D-peptide ligand identification

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Synthetic and Systems Biotechnology 2021年第4期6卷 402-413页

作者： Helena Engel Felix Guischard Fabian Krause janina Nandy Paulina Kaas Nico Hofflin Maja Kohn Normann Kilb Karsten Voigt Steffen Wolf Tahira Aslan Fabian Baezner Salom´e Hahne Carolin Ruckes Joshua Weygant Alisa Zinina Emir Bora Akmeriç Enoch B.Antwi Dennis Dombrovskij Philipp Franke Klara l.lesch Niklas Vesper Daniel Weis Nicole Gensch Barbara Di Ventura Mehmet Ali Oztürk Signalling Research Centres BIOSS and CIBSS University of FreiburgSchanzlestr.1879104FreiburgGermany Institute of Biology III Faculty of BiologyUniversity of FreiburgSchanzlestr.179104FreiburgGermany Institute of Biology II Faculty of BiologyUniversity of FreiburgSchanzlestr.179104FreiburgGermany AG Roth-lab for MicroarrayCopying ZBSA-Centre for Biological Systems AnalysisUniversity of FreiburgHabsburgerstrasse 4979104FreiburgGermany Biomolecular Dynamics Institute of PhysicsUniversity of FreiburgHermann-Herder-Strasse 3a79104FreiburgGermany Core Facility Signalling Factory Centre for Biological Signaling Studies(BIOSS)University of FreiburgSchanzlestr.1879104FreiburgGermany Spemann Graduate School of Biology and Medicine(SGBM) University of FreiburgAlbertstraße 19A79104FreiburgGermany Internal Medicine IV Department of MedicineMedical CenterUniversity of FreiburgHugstetter Straße 5579106FreiburgGermany Institute for Biochemistry University of FreiburgAlbertstr.2179104FreiburgGermany

In the rapidly expanding field of peptide therapeutics,the short in vivo half-life of peptides represents a considerable limitation for drug action.D-peptides,consisting entirely of the dextrorotatory enantiomers of naturally occurring levorotatory amino acids(AAs),do not suffer from these shortcomings as they are intrinsically resistant to proteolytic degradation,resulting in a favourable pharmacokinetic *** experimentally identify D-peptide binders to interesting therapeutic targets,so-called mirror-image phage display is typically performed,whereby the target is synthesized in D-form and l-peptide binders are screened as in conventional phage *** technique is extremely powerful,but it requires the synthesis of the target in D-form,which is challenging for large *** we present finDr,a novel web server for the computational identification and optimization of D-peptide ligands to any protein structure(https://***/).finDr performs molecular docking to virtually screen a library of helical 12-mer peptides extracted from the RCSB Protein Data Bank(PDB)for their ability to bind to the *** a separate,heuristic approach to search the chemical space of 12-mer peptides,finDr executes a customizable evolutionary algorithm(EA)for the de novo identification or optimization of D-peptide *** a proof of principle,we demonstrate the validity of our approach to predict optimal binders to the pharmacologically relevant target phenol soluble modulin alpha 3(PSMα3),a toxin of methicillin-resistant Staphylococcus aureus(MRSA).We validate the predictions using in vitro binding assays,supporting the success of this *** to conventional methods,finDr provides a low cost and easy-to-use alternative for the identification of D-peptide ligands against protein targets of choice without size *** believe finDr will facilitate D-peptide discovery with implications in biotechnology and biomedicine.

关键词： D-peptide Web server Evolutionary algorithm Peptide design Molecular docking Mirror-image phage display