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- silver nanoparticles (6)
- solar cells (6)
- spatial frequencies (6)
- speciation (6)
- speech (6)
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- stars (6)
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- statistics (6)
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- sulfur (6)
- surveillance (6)
- tectonics (6)
- thermokarst (6)
- time series (6)
- training load (6)
- traits (6)
- transcriptome (6)
- transfer (6)
- uncertainty quantification (6)
- urbanization (6)
- AFM (5)
- Absorption (5)
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- Assessment (5)
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- Cue-based retrieval (5)
- Cultural diversity (5)
- DNA damage (5)
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- DRD4 (5)
- Data assimilation (5)
- Decomposition (5)
- Dexamethasone (5)
- Dictyostelium discoideum (5)
- Diffusion (5)
- Disturbance (5)
- EPR (5)
- Ecology (5)
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- Ellenberg indicator values (5)
- Embodiment (5)
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- Simulation (5)
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- Variability (5)
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- Walking (5)
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- age (5)
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- algorithms (5)
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- 4 (4)
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- acid ceramidase (4)
- actin (4)
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- children and adolescents (4)
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- civil war (4)
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- clone (4)
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- coastal erosion (4)
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- competence (4)
- complex networks (4)
- compliance (4)
- computed tomography (4)
- conjugated polymers (4)
- construction (4)
- contrast (4)
- conversation analysis (4)
- cooperation (4)
- core (4)
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- correlations (4)
- corruption (4)
- creep (4)
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- cue-based retrieval (4)
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- data (4)
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- events (4)
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- fabrication (4)
- facilitation (4)
- family (4)
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- finger counting (4)
- first-passage time (4)
- fish (4)
- flood (4)
- flood risk management (4)
- fluorescence microscopy (4)
- food choice (4)
- food webs (4)
- force (4)
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- galaxies: fundamental parameters (4)
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- gelatin (4)
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- line: identification (4)
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- locus of control (4)
- low-energy electrons (4)
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- phosphate (4)
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- plant population and community dynamics (4)
- platelets (4)
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- carbon cycling (2)
- carbon fluxes (2)
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- configuration (2)
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- connections between chaos and statistical physics (2)
- connective (2)
- consequences (2)
- conservation biology (2)
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- consonant bias (2)
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- copolymerization (2)
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- crystal-structure (2)
- crystalline (2)
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- de Rham complex (2)
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- defense against predation (2)
- definition (2)
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- degradable polymers (2)
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- dehydration (2)
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- deuterium (2)
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- dictyostelium (2)
- dielectric (2)
- dielectric barrier discharge (DBD) (2)
- dielectric barrier discharges (2)
- dielectric properties (2)
- dielectric spectroscopy (2)
- dielectrophoresis (2)
- dienes (2)
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- differentiation (2)
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- diffusing diffusivity (2)
- digital education (2)
- digital elevation model (2)
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- digitization (2)
- dimerization (2)
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- discharge (2)
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- maximal subsemigroups (2)
- maximum a posteriori (2)
- maximum magnitude (2)
- mean squared displacement (2)
- measles virus (2)
- measurement error (2)
- mechanical (2)
- mechanical properties (2)
- mechanical tendinous oscillations (2)
- mechanistic models (2)
- medicine (2)
- melts (2)
- membrane proteins (2)
- memory and delay (2)
- mental imagery (2)
- meropenem (2)
- mesocosm (2)
- metaanalysis (2)
- metabolic disease (2)
- metadata (2)
- metagenome (2)
- metal coordination (2)
- metal-organic frameworks (2)
- metamorphosis of international law (2)
- metaphor (2)
- meteorological extremes (2)
- method comparison (2)
- method development (2)
- methodological quality (2)
- methods: MHD (2)
- methyl orange (2)
- methylene blue (2)
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- mica (2)
- micelles (2)
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- microbes (2)
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- microbial communities (2)
- microbial community (2)
- microbial interactions (2)
- microcapsules (2)
- microclimate (2)
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- microemulsion (2)
- microgel (2)
- micronutrients (2)
- microparticle (2)
- microtubule-organization (2)
- microviridins (2)
- mid-temperature transition (2)
- migrants (2)
- mild cognitive impairment (2)
- military culture (2)
- minimal pairs (2)
- minimax convergence rates (2)
- minorities (2)
- mirror (2)
- mirror illusion (2)
- mirror therapy (2)
- miscellaneous (2)
- miscibility gap (2)
- missing-VP effect (2)
- mitochondrial dysfunction (2)
- mitogenome (2)
- mitogenomes (2)
- mixtures (2)
- mobile applications (2)
- mobile health (2)
- mobile links (2)
- mobile phone (2)
- modal verbs (2)
- model coupling (2)
- model validation (2)
- model verification (2)
- modeling language (2)
- modern art (2)
- modernity (2)
- modified Mannich reaction (2)
- modular production (2)
- molecular architecture (2)
- molecular clock (2)
- molecular dynamics simulations (2)
- molecular weight (2)
- molecules (2)
- molybdenum (2)
- moment tensor (2)
- monoclonal antibodies (2)
- monolayer formation (2)
- monomer (2)
- monomers (2)
- moral disengagement (2)
- morality (2)
- morpho-orthography (2)
- morphogenesis (2)
- morphological analysis (2)
- morphological decomposition (2)
- morphological priming (2)
- morphologically complex words (2)
- morphosyntax (2)
- motion capture (2)
- motivation in mathematics (2)
- motivational interviewing (2)
- motor resonance (2)
- motor skills (2)
- motor system (2)
- movement kinematics (2)
- movement patterns (2)
- mowing (2)
- multi-agent system (2)
- multi-level system (2)
- multi-nutrient limitation (2)
- multicultural policy (2)
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- multidiversity (2)
- multidrug resistance (2)
- multifunctional polymers (2)
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- multilevel analyses (2)
- multilevel analysis (2)
- multiple (2)
- multiple sclerosis (2)
- multiscale analysis (2)
- multispectral (2)
- multivariate regression (2)
- multivariate statistics (2)
- murchison meteorite (2)
- muscle action (2)
- muscle metabolism (2)
- muscle oxygen saturation (2)
- muscle physiology (2)
- muscle spindle (2)
- muscle stability (2)
- muscle weakness (2)
- musculoskeletal (2)
- musculoskeletal ultrasound (2)
- music (2)
- music cognition (2)
- music industry (2)
- music information retrieval (2)
- music perception (2)
- mutants (2)
- mutation (2)
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- myopathy (2)
- myth (2)
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- naming (2)
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- nature conservation (2)
- nearshore zone (2)
- need satisfaction (2)
- needs (2)
- negation (2)
- negative numbers (2)
- negative strengthening (2)
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- neo-liberalism (2)
- neogene (2)
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- network dynamics (2)
- neurodegenerative diseases (2)
- neuroenhancement (2)
- neuromuscular functioning (2)
- neuronal networks (2)
- neuropsychology (2)
- neutrality (2)
- neutron powder diffraction (2)
- neutron reflectometry (2)
- neutron stars (2)
- new combination (2)
- next generation sequencing (2)
- niche and fitness differences (2)
- niche theory (2)
- niche width (2)
- nineteenth century (2)
- nitride materials (2)
- nitrile (2)
- nitrogen fixation (2)
- nitrogen limitation (2)
- nitrogen-doped carbon (2)
- noisy systems (2)
- nominalization (2)
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- non-predatory mortality (2)
- nonfullerene acceptors (2)
- nonlinear filtering (2)
- nonlinear operator (2)
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- nonmodel species (2)
- nonradiative recombination (2)
- nonradiative voltage losses (2)
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- noun (2)
- novae, cataclysmic variables (2)
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- novelty (2)
- nucleation (2)
- nucleosome (2)
- number and brightness (2)
- number concepts (2)
- number processing (2)
- numerical distance effect (2)
- numerical model (2)
- nursing home (2)
- nutrient (2)
- nutrient cycling (2)
- nutrient retention (2)
- nutrient stoichiometry (2)
- nutrient supply (2)
- oarsmen (2)
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- observation (2)
- occlusion (2)
- ocean acidification (2)
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- ocean heat uptake (2)
- oil (2)
- oil yield (2)
- older persons (2)
- oligodepsipeptides (2)
- oligomerization (2)
- omics (2)
- on-water performance (2)
- oncology (2)
- one-carbon metabolism (2)
- online (2)
- online course (2)
- online disinhibition (2)
- ontogenesis (2)
- ontogeny (2)
- opacity (2)
- open (2)
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- open innovation (2)
- open-field (2)
- operator-valued symbols (2)
- oppositions (2)
- optical imaging (2)
- optical manipulation (2)
- optical remote sensing (2)
- optical sensors (2)
- optionality (2)
- orbifolds (2)
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- orchestration (2)
- organ growth (2)
- organic carbon (2)
- organic chemistry (2)
- organic electronics (2)
- organization theory (2)
- organizational change (2)
- organizational reform (2)
- origins (2)
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- orogeny (2)
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- orthogroup (2)
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- osmotic-pressure (2)
- osteoblast (2)
- other-race effect (2)
- outbreak (2)
- outcome measures (2)
- overland flow (2)
- overreaching (2)
- overtraining (2)
- overuse injuries (2)
- oxidation state (2)
- oxygen heterocycles (2)
- oxygen plasma (2)
- oxygenation (2)
- p-Aminophenol (2)
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- permutation entropy (2)
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- persulfide (2)
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- phenolic compounds (2)
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- phosphatidylserine (2)
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- photocatalysts (2)
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- photodehydro-Diels-Alder reaction (2)
- photoelectron (2)
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- photoisomerization (2)
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- pitch angle (2)
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- planets and satellites: gaseous planets (2)
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- plant architecture (2)
- plant invasions (2)
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- plant traits (2)
- plant volatiles (2)
- plant-soil (belowground) interactions (2)
- plants (2)
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- plasmasphere (2)
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- plateau (2)
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- poly(epsilon-caprolactone) (2)
- polyadenylation (2)
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- polyester (2)
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- polymersomes (2)
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- polystyrene-block-poly(4-vinylpyridine) (2)
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- pore pressure (2)
- pornography (2)
- porous silicon (2)
- positioning (2)
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- possessives (2)
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- postural sway (2)
- potassium channel (2)
- power spectral analysis (2)
- pp-wave solutions (2)
- practice (2)
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- pre-activity (2)
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- precaution (2)
- predation (2)
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- predator (2)
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- preference (2)
- preference assessment (2)
- preference for agency (2)
- preferential flow (2)
- prefixes (2)
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- preprocessing (2)
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- prestige (2)
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- primary care (2)
- printing (2)
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- probability (2)
- probability density function (2)
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- processes (2)
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- proper motions (2)
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- prospective (2)
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- protected area (2)
- protection motivation theory (2)
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- protein engineering (2)
- protein modification (2)
- protein restriction (2)
- protein search (2)
- protein translocation (2)
- protein-protein (2)
- proteomic analysis (2)
- protest (2)
- protonation (2)
- prototype-willingness-model (2)
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- psychological detachment (2)
- psychological distress (2)
- psychological well-being (2)
- psychologinguistics (2)
- psychopathy (2)
- psychophysics (2)
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- puberty (2)
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- public good (2)
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- publication bias (2)
- pulling isometric muscle action (PIMA) (2)
- pulsars: individual: PSR B0833-45 (2)
- purification (2)
- quality assurance (2)
- quantum (2)
- quantum field theory (2)
- quartz crystal microbalance (2)
- quasi-Fermi level splitting (2)
- quenched energy landscape (2)
- questioning solutions (2)
- radhard design (2)
- radial flow (2)
- radiation mechanisms: nonthermal (2)
- radiation therapy (2)
- radiative forcing (2)
- radiocarbon dating (2)
- radiogenic isotopes (2)
- radiography (2)
- radiosensitizers (2)
- rainfall (2)
- rainfall gradient (2)
- rampage (2)
- random diffusivity (2)
- random matrix theory (2)
- random number generation (2)
- random-walks (2)
- randomized controlled trial (2)
- range dynamics (2)
- range of motion (2)
- range size (2)
- rank (2)
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- rapid test kit (2)
- rare events (2)
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- rate of torque development (2)
- ray tracing (2)
- reactance (2)
- reaction kinetics theory (2)
- reaction monitoring (2)
- reactive transport modeling (2)
- reading motivation (2)
- real-time (2)
- receiver function (2)
- reciprocal class (2)
- recollection (2)
- recollimation shocks (2)
- recombinant inbred line (2)
- recombination order (2)
- record (2)
- record linkage (2)
- recreational sport (2)
- recurrence analysis (2)
- recurrence quantification analysis (2)
- redemption (2)
- redox homeostasis (2)
- redox polymers (2)
- redox processes (2)
- redox state (2)
- reduction (2)
- reed (2)
- referential coding (2)
- reflexives (2)
- reforms (2)
- refugee crisis (2)
- refugee youth (2)
- regional development (2)
- regional flood frequency analysis (2)
- regionalisation (2)
- regularity (2)
- regulations (2)
- regulatory T cells (2)
- regulatory physiology (2)
- reinforcement (2)
- relations (2)
- relationship (2)
- relationship constellations (2)
- relative pollen productivity (2)
- relaxation (2)
- relaxor-ferroelectric polymer (2)
- remission (2)
- remote teaching (2)
- renormalization Hopf algebra (2)
- replacement (2)
- repository far-field (2)
- reproducing kernel Hilbert space (2)
- reproductive strategies (2)
- reproductive success (2)
- resampling (2)
- research challenges (2)
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- research framework (2)
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- research transparency (2)
- reservoir (2)
- reservoir characterization (2)
- resetting (2)
- resolution infrared-spectroscopy (2)
- resonance energy transfer (2)
- resonances (2)
- resource allocation (2)
- resource selection (2)
- restricted range (2)
- resurrection plants (2)
- retentivity (2)
- retrogressive thaw slumps (2)
- retrospective (2)
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- reversible measure (2)
- reward anticipation (2)
- rewards (2)
- rhizosphere (2)
- rhythm (2)
- ribosome assembly (2)
- rifting (2)
- ring current (2)
- ring current electrons (2)
- risk assessment (2)
- risk aversion (2)
- risk communication (2)
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- risk management cycle (2)
- risk perceptions (2)
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- risks (2)
- river erosion (2)
- river floods (2)
- rock (2)
- rock glacier (2)
- role-play (2)
- rolling averages (2)
- root morphology (2)
- root water uptake (2)
- rotational diffusion (2)
- rotifer (2)
- runners (2)
- running mechanics (2)
- rupture (2)
- rupturing of metal film (2)
- réchauffement planétaire (2)
- sACC (2)
- sadness (2)
- salamanders (2)
- salience (2)
- saliency (2)
- salinity (2)
- salivary alpha-amylase (2)
- salivary gland (2)
- salt (2)
- salt pan (2)
- salt structures (2)
- sample preparation (2)
- satellite data (2)
- satisfaction (2)
- savanna ecology (2)
- scaffolding (2)
- scalability (2)
- scale-dependence (2)
- scanning tunneling microscopy (2)
- scene perception (2)
- school learning (2)
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- science (2)
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- scoping review (2)
- scrambling (2)
- sea level (2)
- sea level rise (2)
- second chambers (2)
- second language processing (2)
- secular changes (2)
- secular variation (2)
- sedentary (2)
- sediment core (2)
- sediment routing (2)
- sediment storage (2)
- sediment supply (2)
- sediment transport (2)
- sediment yield (2)
- sediments (2)
- seed (2)
- seed dispersal syndrome (2)
- seed provisioning (2)
- segmentation (2)
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- seismology (2)
- selective autophagy (2)
- selective laser melting (2)
- selective laser melting (SLM) (2)
- selenoprotein P (2)
- self threat (2)
- self-assembled monolayers (2)
- self-control (2)
- self-determination theory (2)
- self-disclosure (2)
- self-enhancement (2)
- self-evaluation (2)
- self-harm (2)
- self-incompatibility (2)
- self-isolation (2)
- self-objectification (2)
- self-organisation (2)
- self-regulated learning (2)
- self-similarity (2)
- self-sovereign identity (2)
- semantic transparency (2)
- semi-arid hydrology (2)
- semi-parliamentarism (2)
- semiconducting polymers (2)
- semiconductor lasers (2)
- sensor (2)
- sensor alignment (2)
- sensor data (2)
- sensor fusion (2)
- sensors and actuators (2)
- sentence parsing (2)
- sentinel-1 (2)
- separation of powers (2)
- sequential data assimilation (2)
- serious game (2)
- serum (2)
- sexual aggression perpetration (2)
- sexual behavior (2)
- sexual coercion (2)
- sexual dimorphism (2)
- sexual reproduction (2)
- sexual self-esteem (2)
- sexual victimisation (2)
- sexual violence (2)
- shadow education (2)
- shallow structure hypothesis (2)
- shieldings (TSNMRS) (2)
- shoe (2)
- short latency response (2)
- short-read mapping (2)
- shortening (2)
- shotgun sequencing (2)
- shoulder (2)
- shrub-encroachment (2)
- sibilant (2)
- sick leave (2)
- signal propagation (2)
- signalling (2)
- silica (2)
- silver (2)
- simulation model (2)
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- simultaneous bilingualism (2)
- single event transients (2)
- single-case experimental design (2)
- single-cell analysis (2)
- single-particle tracking (2)
- situational strength (2)
- size (2)
- size distribution (2)
- skeletal muscle (2)
- skill (2)
- slope aspect (2)
- smart materials (2)
- soccer players (2)
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- social inequality (2)
- social interaction (2)
- social modulation (2)
- social network (2)
- social reactivity (2)
- social robots (2)
- socioeconomy (2)
- sodium hydroxide etching (2)
- soft errors (2)
- soft robotics (2)
- soft-templating (2)
- software process improvement (2)
- soil fatigue (2)
- soil landscape (2)
- soils (2)
- solar powered light-emitting diode (2)
- solubility (2)
- solvent vapor annealing (2)
- somatic variables (2)
- source parameters (2)
- source-sink dynamics (2)
- soy protein (2)
- space use (2)
- space-charge stability (2)
- spacing (2)
- spatial autocorrelation (2)
- spatial heterogeneity (2)
- spatial scales (2)
- spatial vision (2)
- spatially explicit model (2)
- speakers (2)
- special education (2)
- special educational needs (2)
- species assembly (2)
- species diversity (2)
- species interactions (2)
- species recognition (2)
- specific language impairment (2)
- specificity (2)
- specifier proteins (2)
- spectral analysis (2)
- spectroscopic ellipsometry (2)
- speech motor control (2)
- speech segmentation (2)
- speed-accuracy trade-off (2)
- speleothems (2)
- sphingomyelin (2)
- sphingosine kinase (2)
- spider silk (2)
- spin transition (2)
- spin-orbit coupling (2)
- spin-orbit interaction (2)
- split Hopkinson pressure bar (2)
- splitting (2)
- sport (2)
- sports medicine (2)
- sprint (2)
- sprints (2)
- stable carbon isotopes (2)
- stable matching (2)
- stakeholder engagement (2)
- standard (2)
- starch granule initiation (2)
- starch granule morphology (2)
- starch granules (2)
- starch morphology (2)
- starch synthase (2)
- stars: flare (2)
- stars: individual ([HD 36486]delta Ori A) (2)
- stars: individual (gamma Cassiopeiae) (2)
- stars: individual: WR 102c (2)
- stars: individual: WR 102ka (2)
- stars: jets (2)
- stars: solar-type (2)
- stars: variables: Cepheids (2)
- starvation (2)
- statistical methods (2)
- statistical tools (2)
- stem cell adhesion (2)
- step selection (2)
- stereoselectivity (2)
- stereotypes (2)
- sterol (2)
- stimulus-response compatibility (2)
- stokes shift (2)
- storage capacity (2)
- strain localization (2)
- strategic growth adjustment (2)
- strategy (2)
- stratification (2)
- streptavidin (2)
- stressors (2)
- strong semilattice of semigroups (2)
- structural change (2)
- structural health monitoring (2)
- structural thermodynamics (2)
- structures (2)
- study abroad (2)
- study designs (2)
- stumbling (2)
- style transfer (2)
- subcellular localization (2)
- subcutaneous adipose tissue (2)
- subduction initiation (2)
- subject-oriented learning (2)
- submarine (2)
- submillimetre: ISM (2)
- subsea permafrost (2)
- substituent effects (2)
- substitution effects (2)
- subsurface life (2)
- succession (2)
- sufficiency (2)
- suicidality (2)
- sulfite oxidase (2)
- superalloys (2)
- superoxide dismutase (2)
- supersaturated species coexistence (2)
- supervised machine learning (2)
- supervisor support (2)
- supply chains (2)
- support vector machines (2)
- supramolecular chemistry (2)
- surface charge (2)
- surface electromyography (2)
- surface functionalization (2)
- surface interaction (2)
- surface wave (2)
- surface-enhanced Raman spectroscopy (2)
- susceptibility (2)
- sustainability science (2)
- swallowing (2)
- syllables (2)
- symptom checker apps (2)
- synchronization transition (2)
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- Institut für Physik und Astronomie (4399)
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- Institut für Geowissenschaften (2911)
- Institut für Chemie (2501)
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This chapter investigates the trajectory of establishing the Forest Stewardship Council (FSC) in the early 1990s as the first private transnational certification organization with an antagonistic stakeholder body. Its main contribution is a micro-analysis of the founding assembly in 1993. By investigating the role of brokers within the negotiation as one institutional scope condition for ‘arguing’ having occurred, the chapter adopts a dramaturgical approach. It contends that the authority of brokers is not necessarily institutionally given, but needs to be gained: brokers have to prove situationally that their knowledge is relevant and that they are speaking impartially in the interest of progress rather than their own. The chapter stresses the importance of procedural knowledge which brokers provide in contrast to policy knowledge.
In this article the author proposes a new reading for the opening words of the Bible, "In the beginning God created the heaven and the earth. Now the earth was unformed and void ... ; and the spirit of God hovered over the water" (Gen. 1:1-2). This new reading is based on the connections drawn by Otto Eissfeldt between the Ugaritic literature and the Bible. God, according to this opening picture, connects intimately, empathetically, with the existing matter (the tehom) in dialogic address. It is from this relationship, which today we call "love," that all comes to be "born" from the material "womb" of the tehom. From this "big bang," all continues to be born.
"At-risk" concept
(2005)
"BreaThink"
(2021)
Cognition is shaped by signals from outside and within the body. Following recent evidence of interoceptive signals modulating higher-level cognition, we examined whether breathing changes the production and perception of quantities. In Experiment 1, 22 adults verbally produced on average larger random numbers after inhaling than after exhaling. In Experiment 2, 24 further adults estimated the numerosity of dot patterns that were briefly shown after either inhaling or exhaling. Again, we obtained on average larger responses following inhalation than exhalation. These converging results extend models of situated cognition according to which higher-level cognition is sensitive to transient interoceptive states.
An alternative method for the structure tuning of carbon nitride materials by using a supramolecular approach in combination with caffeine as lining-agent is described. The self-assembly of the precursor complex consisting of melamine and cyanuric acid can be controlled by this doping molecule in terms of morphology, electronic, and photophysical properties. Caffeine is proposed to insert as an edge-molecule eventually leading to hollow tube-like carbon nitride structures with improved efficiency of charge formation. Compared to the bulk carbon nitride, the caffeine-doped analogue possesses a higher photocatalytic activity for the degradation of rhodamineB dye. Furthermore, this approach is also shown to be suitable for the modification of carbon nitride electrodes.
This article provides a survey of the research carried out by Celtic scholars in Germany during the 15 years between 1980 and 1995. It is based on the respective bibliography published in 'Studia Celtica Japonica' 9 (1997). The major research fields covered are IE Studies, Celtic philology, linguistics, literature, archaeology and cultural studies.
Background: There is an increasing awareness of the impact of parental risk perception on the weight course of the child and the parent's readiness to engage in preventive efforts, but only less is known about factors related to the parental perception of the right time for the implementation of preventive activities. The aim of this study was to examine parental perceptions of the appropriate time to engage in child weight management strategies, and the factors associated with different weight points at which mothers recognize the need for preventive actions.
Methods: 352 mothers with children aged 2-10 years took part in the study. We assessed mothers' perceptions of the actual and preferred weight status of their child, their ability to identify overweight and knowledge of its associated health risks, as well as perceptions of the right time for action to prevent overweight in their child. A regression analysis was conducted to examine whether demographic and weight related factors as well as the maternal general risk perception were associated with recognizing the need to implement prevention strategies.
Results: Although most of the parents considered a BMI in the 75th to 90th percentile a valid reason to engage in the prevention of overweight, 19% of the mothers were not willing to engage in prevention until their child reached the 97th percentile. Whereas the child's sex and the identification of an elevated BMI were significant predictors for parents' recognition of the 75th percentile as right point to engage in prevention efforts, an inability to recognize physical health risks associated with overweight silhouettes emerged as a significant factor predicting which parents would delay prevention efforts until a child's BMI reached the 97th percentile.
Conclusion: Parental misperceptions of overweight and associated health risks constitute unfavorable conditions for preventive actions. Feedback on the health risks associated with overweight could help increase maternal readiness for change.
Driven mostly by the search for chemical syntheses under biocompatible conditions, so called "click" chemistry rapidly became a growing field of research. The resulting simple one-pot reactions are so far only scarcely accompanied by an adequate optimization via comparably straightforward and robust analysis techniques possessing short set-up times. Here, we report on a fast and reliable calibration-free online NMR monitoring approach for technical mixtures. It combines a versatile fluidic system, continuous-flow measurement of H-1 spectra with a time interval of 20 s per spectrum, and a robust, fully automated algorithm to interpret the obtained data. As a proof-of-concept, the thiol-ene coupling between N-boc cysteine methyl ester and ally] alcohol was conducted in a variety of non-deuterated solvents while its time-resolved behaviour was characterized with step tracer experiments. Overlapping signals in online spectra during thiol-ene coupling could be deconvoluted with a spectral model using indirect hard modeling and were subsequently converted to either molar ratios (using a calibration free approach) or absolute concentrations (using 1-point calibration). For various solvents the kinetic constant k for pseudo-first order reaction was estimated to be 3.9 h(-1) at 25 degrees C. The obtained results were compared with direct integration of non-overlapping signals and showed good agreement with the implemented mass balance. (C) 2017 Elsevier Inc. All rights reserved.
"Deal of the Day" (DoD) platforms have quickly become popular by offering savings on local services, products and vacations. For merchants, these platforms represent a new marketing channel to advertise their products and services and attract new customers. DoD platform providers, however, struggle to maintaining a stable market share and profitability, because entry and switching costs are low. To sustain a competitive market position, DoD providers are looking for ways to build a loyal customer base. However, research examining the determinants of user loyalty in this novel context is scarce. To fill this gap, this study employs Grounded Theory methodology to develop a conceptual model of customer loyalty to a DoD provider. In the next step, qualitative insights are enriched and validated using quantitative data from a survey of 202 DoD users. The authors find that customer loyalty is in large part driven by monetary incentives, but can be eroded if impressions from merchant encounters are below expectations. In addition, enhancing the share of deals relevant for consumers, i.e. signal-to-noise ratio, and mitigating perceived risks of a transaction emerge as challenges. Beyond theoretical value, the results offer practical insights into how customer loyalty to a DoD provider can be promoted.
Ionic liquids are well known for their high gas absorption capacity. It is shown that this is not a solvent constant, but can be enhanced by another factor of 10 by pore confinement, here of the ionic liquid (IL) 1-ethyl-3-methylimidazolium acetate (EmimOAc) in the pores of carbon materials. A matrix of four different carbon compounds with micro- and mesopores as well as with and without nitrogen doping is utilized to investigate the influence of the carbons structure on the nitrogen uptake in the pore-confined EmimOAc. In general, the absorption is most improved for IL in micropores and in nitrogen-doped carbon. This effect is so large that it is already seen in TGA and DSC experiments. Due to the low vapor pressure of the IL, standard volumetric sorption experiments can be used to quantify details of this effect. It is reasoned that it is the change of the molecular arrangement of the ions in the restricted space of the pores that creates additional free volume to host molecular nitrogen.
The aim of this study was to develop a one-step synthesis of gold nanotriangles (NTs) in the presence of mixed phospholipid vesicles followed by a separation process to isolate purified NTs. Negatively charged vesicles containing AOT and phospholipids, in the absence and presence of additional reducing agents (polyampholytes, polyanions or low molecular weight compounds), were used as a template phase to form anisotropic gold nanoparticles. Upon addition of the gold chloride solution, the nucleation process is initiated and both types of particles, i.e., isotropic spherical and anisotropic gold nanotriangles, are formed simultaneously. As it was not possible to produce monodisperse nanotriangles with such a one-step procedure, the anisotropic nanoparticles needed to be separated from the spherical ones. Therefore, a new type of separation procedure using combined polyelectrolyte/micelle depletion flocculation was successfully applied. As a result of the different purification steps, a green colored aqueous dispersion was obtained containing highly purified, well-defined negatively charged flat nanocrystals with a platelet thickness of 10 nm and an edge length of about 175 nm. The NTs produce promising results in surface-enhanced Raman scattering.
Background:
Cyberhate is a growing form of online aggression against a person or a group based on race, ethnicity, nationality, sexual orientation, gender, religion, or disability. The present study aims to examine psychometric properties of the Coping with Cyberhate Questionnaire, the prevalence of coping strategies in Spanish adolescents, differences in coping strategies based in sex, age, and victim status, and the association between coping with cyberhate and adolescents' mental well-being.
Method:
The sample consisted of 1,005 adolescents between 12 and 18 years old (Mage = 14.28 years, SD = 1.63; 51.9% girls) who completed self-report measures on coping strategies, victimization status, and mental well-being.
Results:
The results of confirmatory factor analyses showed a structure for the Coping with Cyberhate Questionnaire composed of six factors, namely Distal advice, Assertiveness, Helplessness/Selfblame, Close support, Technical coping, and Retaliation. It demonstrated acceptable internal consistency. The three most frequently endorsed coping strategies were Technical coping, Close support, and Assertiveness. In addition, lower Helplessness/Self-blame, and higher Close-support, Assertiveness, and Distal advice were significantly related to adolescents' better mental well-being.
Conclusion:
Prevention programs that educate adolescents about how to deal with cyberhate are needed.
The majority of middle-age children do not meet current physical activity guidelines. There is growing evidence that adults' physical activity is partially influenced by automatic affective processes, which are derived from affective experiences with physical activity.
However, little is known about whether these processes are interrelated with children's physical activity level.
A prospective design was used to examine whether automatic affective processes assessed by an evaluative priming procedure predict physical activity of children.
Physical activity of 48 children (8.71 +/- 0.71 years; 65% girls) was measured for 1 week with activity trackers.
In a linear regression model, automatic affective processes (beta = 0.36) significantly predicted physical activity, accounting for 11.02% of variance.
These results indicate that physical-activity-related automatic affective processes are associated with children's physical activity, as has previously been found in adults.
This study emphasizes the importance of fostering positive affective experiences associated with physical activity during childhood.
Doping use in recreational sports is an emerging issue that has received limited attention so far in the psychological literature. The present study assessed the lifetime prevalence of controlled performance and appearance enhancing substances ( PAES), and used behavioral reasoning theory to identify the reasons for using and for avoiding using controlled PAES in young exercisers across five European countries, in the context of the "SAFE YOU" Project. Participants were 915 young amateur athletes and exercisers (M = 21.62; SD = 2.62) from Cyprus, Germany, Greece, Italy, and UK who completed an anonymous questionnaire that included measures of self-reported use of controlled PAES, as well as reasons for using and not using controlled PAES. The results of the descriptive analyses demonstrated that almost one out five exercisers in the sample had a previous experience with controlled PAES. Higher prevalence rates were found in Greece and Cyprus and lower in Italy. The most frequently reported reasons for using controlled PAES included achieving the desired results faster; pushing the self to the (physical) limits; and recovering faster after exercise/training. Furthermore, the most frequently reported reasons for not using controlled PAES involved worry about any possible adverse health effects; not feeling the need for using them; and wanting to see what can be achieved naturally without using any controlled PAES. The findings of the present study indicate that the use of controlled PAES is fast becoming a crisis in amateur sports and exercise settings and highlight the need for preventive action and concerted anti-doping education efforts.
Somewhat surprisingly, inverted ("O-down") CO adsorbates on NaCl(100) were recently observed experimentally after infrared vibrational excitation (Lau et al., Science, 2020, 367, 175-178). Here we characterize these species using periodic density functional theory and a quantum mechanical description of vibrations. We determine stationary points and minimum energy paths for CO inversion, for low (1/8 and 1/4 monolayers (ML)) and high (1 ML) coverages. Transition state theory is applied to estimate thermal rates for "C-down" to "O-down" isomerization and the reverse process. For the 1/4 ML p(1 x 1) structure, two-dimensional and three-dimensional potential energy surfaces and corresponding anharmonic vibrational eigenstates obtained from the time-independent nuclear Schrodinger equation are presented. We find (i) rather coverage-independent CO inversion energies (of about 0.08 eV or 8 kJ mol(-1) per CO) and corresponding classical activation energies for "C-down" to "O-down" isomerization (of about 0.15 eV or 14 kJ mol(-1) per CO); (ii) thermal isomerization rates at 22 K which are vanishingly small for the "C-down" to "O-down" isomerization but non-negligible for the back reaction; (iii) several "accidentally degenerate" pairs of eigenstates well below the barrier, each pair describing "C-down" to "O-down" localized states.
"Kontraktmanagement" - Experiences with internal management contracts on German local government
(2000)
"Kontraktmanagement" : experiences with internal management contracts in German local government
(1997)
At the suggestion of the then editor of 'Studia Celtica Japonica,' Professor Toshio Doi, this bibliography lists the returns of a questionnaire sent to all scholars in Germany who were actively involved in Celtic Studies between 1980 and 1995. They were asked to list all their publications in the field of Celtic Studies, so as to allow to carry out a survey of their research activities during this period. While most scholars kindly obliged by returning their lists, there were notable exceptions who never answered the query. Regretably, the present bibliography therefore contains important gaps, which, however, may be quite telling as far as the research situation in Germany was concerned during that period.
The "Lomonosov" space project is lead by Lomonosov Moscow State University in collaboration with the following key partners: Joint Institute for Nuclear Research, Russia, University of California, Los Angeles (USA), University of Pueblo (Mexico), Sungkyunkwan University (Republic of Korea) and with Russian space industry organi-zations to study some of extreme phenomena in space related to astrophysics, astroparticle physics, space physics, and space biology. The primary goals of this experiment are to study: -Ultra-high energy cosmic rays (UHECR) in the energy range of the Greizen-ZatsepinKuzmin (GZK) cutoff; -Ultraviolet (UV) transient luminous events in the upper atmosphere; -Multi-wavelength study of gamma-ray bursts in visible, UV, gamma, and X-rays; -Energetic trapped and precipitated radiation (electrons and protons) at low-Earth orbit (LEO) in connection with global geomagnetic disturbances; -Multicomponent radiation doses along the orbit of spacecraft under different geomagnetic conditions and testing of space segments of optical observations of space-debris and other space objects; -Instrumental vestibular-sensor conflict of zero-gravity phenomena during space flight. This paper is directed towards the general description of both scientific goals of the project and scientific equipment on board the satellite. The following papers of this issue are devoted to detailed descriptions of scientific instruments.
"Make a Run for the Border": Chicano Performance Art and the Search for a Space of/for Difference
(2005)
Being perceived as a foreigner regardless of one's generational status, citizenship, or self-identification is called foreigner objectification. This is a form of identity denial and is linked to psychological distress. To test how foreigner objectification could be measured in Europe, we assessed whether the Foreigner Objectification Scale demonstrated reliability and validity with German adolescents. The sample included 806 9th graders from 17 high schools. The results showed that the scale demonstrates good reliability, scalar measurement invariance across gender and citizenship status, and partial scalar measurement invariance across family heritage, generational status, and cultural self-identification. Adolescents who scored higher on the scale also reported greater school behavioral disengagement, lower life satisfaction, and stronger ethnic identity. Our findings suggest that the scale is psychometrically sound and is linked in theoretically consistent ways to adjustment and ethnic identity. We conclude that this scale offers another way to capture subtle discrimination experiences that add to a more comprehensive understanding of discrimination and the related implications in Europe.
This paper focuses on two different strategies to incorporate gold nanoparticles (AuNPs) into the matrix of polyacrylamide (PAAm) hydrogels. Poly(ethyleneimine) (PEI) is used as both reducing and stabilizing agent for the formation of AuNPs. In addition, the influence of an ionic liquid (IL) (i.e., 1-ethyl-3-methylimidazolium ethylsulfate) on the stability of the nanoparticles and their immobilization in the hydrogel is investigated The results show that AuNPs surrounded by a shell containing PEI and IL, synthesized according to the one-pot approach, are much better immobilized within the PAAm hydrogel. Hereby, the IL is responsible for structural changes in the hydrogel as well as the improved stabilization and embedding of the AuNPs into the polymer gel matrix.
"Orfeo out of Care"
(2022)
The paper focuses on an example of multiple-step reception: the contribution of the classical story of Orpheus and Eurydice and the mediaeval lay Sir Orfeo to Tolkien’s work.
In the first part, I compare the lay with Virgilian and Ovidian versions of Orpheus’ myth. This comparison shows the anonymous author’s deep knowledge of the ancient texts and complex way of rewriting them through stealing and hybridization.
The lay was highly esteemed by Tolkien, who translated it and took inspiration from it while describing the Elven kingdom in The Hobbit and building the storyline of Beren and Lúthien in The Silmarillion. Through this key tale, Orpheus/Orfeo’s romance has a deep influence also on Aragorn and Arwen’s story in The Lord of the Rings. The most important element that Tolkien takes from the Sir Orfeo figuration of the ancient story is undoubtedly the insertion of political theme: the link established between the recovery of the main character’s beloved and the return to royal responsability.
The second part of the paper is, thus, dedicated to the reception of Sir Orfeo and the classical myth in Tolkien. It shows how in his work the different steps of the tradition of Orpheus’ story are co-present, creating an inextricable substrate of inspiration that nourishes his imagination.
The epitope imprinting approach applies exposed peptides as templates to synthesize Molecularly Imprinted Polymers (MIPs) for the recognition of the parent protein. While generally the template protein binding to such MIPs is considered to occur via the epitope-shaped cavities, unspecific interactions of the analyte with non-imprinted polymer as well as the detection method used may add to the complexity and interpretation of the target rebinding. To get new insights on the effects governing the rebinding of analytes, we electrosynthesized two epitope-imprinted polymers using the N-terminal pentapeptide VHLTP-amide of human hemoglobin (HbA) as the template. MIPs were prepared either by single-step electrosynthesis of scopoletin/pentapeptide mixtures or electropolymerization was performed after chemisorption of the cysteine extended VHLTP peptide. Rebinding of the target peptide and the parent HbA protein to the MIP nanofilms was quantified by square wave voltammetry using a redox probe gating, surface enhanced infrared absorption spectroscopy, and atomic force microscopy. While binding of the pentapeptide shows large influence of the amino acid sequence, all three methods revealed strong non-specific binding of HbA to both polyscopoletin-based MIPs with even higher affinities than the target peptides.
Historical narratives play an important role in constructing contemporary notions of citizenship. They are sites on which ideas of the nation are not only reaffirmed but also contested and reframed. In contemporary Germany, dominant narratives of the country's modern history habitually focus on the legacy of the Third Reich and tend to marginalize the country's rich and highly complex histories of immigration. The article addresses this commemorative void in relation to Berlin's urban landscape. It explores how the city's multilayered architecture provides locations for the articulation of marginal memoriesand hence sites of urban citizenshipthat are often denied to immigrant communities on a national scale. Through a detailed examination of a small celebration in 1965 that marked the anniversary of the founding of the modern Turkish republic, the article engages with the layers of history that coalesce around such sites in Berlin.
Carbon suboxide (C3O2) is a unique molecule able to polymerize spontaneously into highly conjugated light-absorbing structures at temperatures as low as 0 degrees C. Despite obvious advantages, little is known about the nature and the functional properties of this carbonaceous material. In this work, the aim is to bring "red carbon," a forgotten polymeric semiconductor, back to the community's attention.
A solution polymerization process is adapted to simplify the synthesis and control the structure.
This allows one to obtain this crystalline covalent material at low temperatures. Both spectroscopic and elemental analyses support the chemical structure represented as conjugated ladder polypyrone ribbons.
Density functional theory calculations suggest a crystalline structure of AB stacks of polypyrone ribbons and identify the material as a direct bandgap semiconductor with a medium bandgap that is further confirmed by optical analysis.
The material shows promising photocatalytic performance using blue light.
Moreover, the simple condensation-aromatization route described here allows the straightforward fabrication of conjugated ladder polymers and can be inspiring for the synthesis of carbonaceous materials at low temperatures in general.
Cryo-electron microscopy, atomic force microscopy, and light microscopy investigations provide experimental evidence that amphiphilic emulsion copolymerization particles change their morphology in dependence on concentration. The shape of the particles is spherical at solids content above 1%, but it changes to rod-like, ring-like, and web-like structures at lower concentrations. In addition, the shape and morphology of these particles at low concentrations are not fixed but very flexible and vary with time between spheres, flexible pearlnecklace structures, and stretched rods.
Several series of presumed dual thermo-responsive diblock copolymers consisting of one non-ionic and one zwitterionic block were synthesized via consecutive reversible addition-fragmentation chain transfer (RAFT) polymerization. For all copolymers, poly(N-isopropylmethacrylamide) was chosen as non-ionic block that shows a coil-to-globule collapse transition of the lower critical solution temperature (LCST) type. In contrast, the chemical structure of zwitterionic blocks, which all belonged to the class of poly(sulfobetaine methacrylate)s, was varied broadly, in order to tune their coil-to-globule collapse transition of the upper critical solution temperature (UCST) type. All polymers were labeled with a solvatochromic fluorescent end-group. The dual thermo-responsive behavior and the resulting multifarious temperature-dependent self-assembly in aqueous solution were mapped by temperature resolved turbidimetry, H-1 NMR spectroscopy, dynamic light scattering (DLS), and fluorescence spectroscopy. Depending on the relative positions between the UCST-type and LCST-type transition temperatures, as well as on the width of the window in-between, all the four possible modes of stimulus induced micellization can be realized. This includes classical induced micellization due to a transition from a double hydrophilic, or respectively, from a double hydrophobic to an amphiphilic state, as well as "schizophrenic" behavior, where the core- and shell-forming blocks are inverted. The exchange of the roles of the hydrophilic and hydrophobic block in the amphiphilic states is possible through a homogeneous intermediate state or a heterogeneous one. (C) 2017 Elsevier Ltd. All rights reserved.
New forms of communication and greater accessibility of Islamic texts on-line allow Muslims to shape their own religiosity, to become less dependent on established sources of authority, and thereby to become more aware of their own cultural diversity as a community. New practices of transnational Islam, and the growth of new concepts of Muslim identities currently emerging in the on-line community, are relatively free from immediate constraints. This article provides the result of a sociological analysis of three Internet sites in Sydney which deliver on-line fatwas. Even if cyberspace has allowed the Muslim world to be de-territorialised and provides a way for people to distance themselves from traditional communities if they wish, this research points out a variety of approaches, including one case which is aiming at re-localising an Australian Muslim system of values. This case highlights ways in which first generation Muslims are re-territorialising Shari'a in a specific western country.
Cost-efficient, visible-light-driven hydrogen production from water is an attractive potential source of clean, sustainable fuel. Here, it is shown that thermal solid state reactions of traditional carbon nitride precursors (cyanamide, melamine) with NaCl, KCl, or CsCl are a cheap and straightforward way to prepare poly(heptazine imide) alkali metal salts, whose thermodynamic stability decreases upon the increase of the metal atom size. The chemical structure of the prepared salts is confirmed by the results of X-ray photoelectron and infrared spectroscopies, powder X-ray diffraction and electron microscopy studies, and, in the case of sodium poly(heptazine imide), additionally by atomic pair distribution function analysis and 2D powder X-ray diffraction pattern simulations. In contrast, reactions with LiCl yield thermodynamically stable poly(triazine imides). Owing to the metastability and high structural order, the obtained heptazine imide salts are found to be highly active photo-catalysts in Rhodamine B and 4-chlorophenol degradation, and Pt-assisted sacrificial water reduction reactions under visible light irradiation. The measured hydrogen evolution rates are up to four times higher than those provided by a benchmark photocatalyst, mesoporous graphitic carbon nitride. Moreover, the products are able to photocatalytically reduce water with considerable reaction rates, even when glycerol is used as a sacrificial hole scavenger.
"The greatest son of our Heimat": reading German Leichhardts across the National Socialist era
(2015)
The article discusses German commemorations of Ludwig Leichhardt (1813-1848) in the National Socialist era when officials, journalists, educators and writers, spurred by the double anniversary of the explorer's 125th birthday and the 90th anniversary of his disappearance, began to re-imagine the explorer's life and fate in the light of the ideological imperatives of the day. Our analysis of this period pays particular attention to how these reimagined Leichhardts emphasise or neglect some of the key elements that make up his story to this day, among them: Leichhardt's ethnicity; his sense of attachment to place and home; his homosocial relationships; his evasion of Prussian military service; his role in the British colonial project; and finally, his engagements with Aborigines. On the one hand, our analysis reveals, how Leichhardt was portrayed first on the local and, later, the national level in ways that increasingly sought to elide ambiguous aspects of his life and deeds. However, it also uncovers some of the ideological labour required to render him useful to the National Socialist cause. Often enough, these re-imagined Leichhardts escaped party politics, and cast up some of the logical inconsistencies and limits to key terms in National Socialist thinking.
In the context of the “postcatastrophic” culture after the Shoah, the question of the ethics of seeing has developed its own specificity and incisiveness, one that resulted from the complex distribution of the visibility and invisibility of the criminal acts themselves.
On the one hand, the perpetrators’ efforts to conceal their crimes and erase their tracks stood in opposition to the desire of the same to meticulously document their crimes. On the other hand, local communities became direct eyewitnesses to the persecution and killing of Jews—in mass shootings as well as in the extermination camps, which were frequently set up close to populated areas.
It is precisely these two aspects—the photographic archives of the perpetrators as well as the bystanders’ eyewitnessing—around which heated debates unfold.
They are also of primary interest to postmemorial art, which grapples with the legacy of this visuality and visibility of the Shoah.
This chapter discusses the possibility of a critical analysis of the images from contaminated photographic material in the Nazi archives in postmemorial art and film as well as artistic projects focussing on the problem of visibility and seeing that deal with the question of the possibility of the witnessing of bystanders and of future generations who are faced with the legacy of the bystander experience.
These projects were developed during the time of intense examination—and not only artistic—of the role of direct eyewitnesses to the Shoah, examinations that were characteristic for the public discourse in Poland after the year 2000.
This article investigates a public debate in Germany that put a special spotlight on the interaction of standard language ideologies with social dichotomies, centering on the question of whether Kiezdeutsch, a new way of speaking in multilingual urban neighbourhoods, is a legitimate German dialect. Based on a corpus of emails and postings to media websites, I analyse central topoi in this debate and an underlying narrative on language and identity. Central elements of this narrative are claims of cultural elevation and cultural unity for an idealised standard language High German', a view of German dialects as part of a national folk culture, and the construction of an exclusive in-group of German' speakers who own this language and its dialects. The narrative provides a potent conceptual frame for the Othering of Kiezdeutsch and its speakers, and for the projection of social and sometimes racist deliminations onto the linguistic plane.
Als die SED-Diktatur zusammenbrach, übte der Glanz der ostdeutschen Medaillen nach wie vor eine große Anziehungskraft aus, vor allem auf westdeutsche Sportpolitiker. Der Sport war ein Spezialfall der deutschen Vereinigung, da hier der Westen vom Osten zu lernen hoffte. Bald jedoch wurden die dunklen Seiten des DDR-Sports offensichtlich: die Verstrickung mit dem Ministerium für Staatsicherheit ebenso wie das staatlich forcierte Zwangsdoping. Bis heute gehen die Meinungen über den DDR-Sport weit auseinander: während die Einen ihn als repressiv und unmenschlich verurteilen, wird er von den Anderen gleichzeitig als Organisationsvorbild für die Zukunft gehandelt.
Empirical evidence of the relationship between social support and post-disaster mental health provides support for a general beneficial effect of social support (main-effect model; Wheaton, 1985). From a theoretical perspective, a buffering effect of social support on the negative relationship between disaster-related stress and mental health also seems plausible (stress-buffering model; Wheaton, 1985). Previous studies, however, (a) have paid less attention to the buffering effect of social support and (b) have mainly relied on interpersonal support (but not collective-level support such as community resilience) when investigating this issue. This previous work might have underestimated the effect of support on post-disaster mental health. Building on a sample of residents in Germany recently affected by flooding (N = 118), we show that community resilience to flooding (but not general interpersonal social support) buffered against the negative effects of flooding on post-disaster mental health. The results support the stress-buffering model and call for a more detailed look at the relationship between support and resilience and post-disaster adjustment, including collective-level variables.
Cross-dressing took on new political meanings in Germany's Weimar Republic, with the emergence of organizations and periodicals aimed at promoting the interests of self-identified "transvestites." This new sexological category, developed by Magnus Hirschfeld in 1910, formed the basis for a shared sense of identity and belonging among individuals who identified as members of the "opposite" sex. Drawing on the experiences of the homosexual emancipation movement and discourses of bourgeois respectability, middle-class transvestites came together to demand legal and social recognition, including acknowledgement of "transsexual" desires. Their efforts represent a critical but forgotten moment in the history of transgender political activism.
Participation has become an orthodoxy in the field of development, an essential element of projects and programmes. This book analyses participation in development interventions as an institutionalised expectation – a rationalized myth – and examines how organisations on different levels of government process it. At least two different objectives of participation are appropriate and legitimate for international organisations in the field: the empowerment of local beneficiaries and the achievement of programme goals. Both integrate participatory forums into the organisational logic of development interventions. Local administrations react to the institutionalised expectation with means-ends decoupling, where participatory forums are implemented superficially but de facto remain marginalised in local administrative processes and activities. The book furthermore provides a thick description of the organisationality of participation in development interventions. Participatory forums are shown to be a form of partial organisation. They establish an order in the relationship between administrations and citizens through the introduction of rules and the creation of a defined membership. At the same time, this order is found to be fragile and subject to criticism and negotiation.
"Writing with my professors”
(2023)
Kollaboratives Forschen quer zu hegemonialen Wissensordnungen gilt als wichtiger Baustein dekolonialer Wissenspraxis. Gemeinsame Schreibprozesse von Wissenschaftler*innen und ihren nicht-wissenschaftlichen Forschungspartner*innen sind allerdings selten und eine methodologische und forschungspraktische Reflexion fehlt. Die Beiträger*innen widmen sich diesen Lücken, indem sie erfolgreiche, aber auch gescheiterte Projekte kollaborativer Textproduktion zwischen Universität und Feld vorstellen und auf ihr Potenzial als transformative und dekoloniale Wissenspraxis befragen. So entsteht eine praktische Orientierungshilfe, die gleichzeitig die interdisziplinäre Diskussion anregt.
Two decades ago, Tarana Burke started using the phrase ‘me too’ to release victims of sexual abuse and rape from their shame and to empower girls from minority communities. In 2017, actress Alyssa Milano made the hashtag #MeToo go viral. This article’s concern is with the role of testimonial practices in the context of sexual violence. While many feminists have claimed that the word of those who claim to being sexually violated by others (should) have political and/or epistemic priority, others have failed to recognize the harm and injury of instances of sexual violence that are not yet acknowledged as such and failed to listen to victims from marginalized social groups. In fact, some feminists have attacked #MeToo for mingling accounts of ‘proper’ sexual violence and accounts that are not ‘proper’ experiences of sexual violence. My aim in this article is to show why this critique is problematic and find a philosophically fruitful way to understand the #MeToo-movement as a movement that strives for moral and conceptual progress.
'...just as it would have been in 1861' : stuttering colonial beginnings in ABC's outback house
(2010)
Formate dehydrogenase (FDH) enzymes are attractive catalysts for potential carbon dioxide conversion applications. The FDH from Rhodobacter capsulatus (RcFDH) binds a bis-molybdopterin-guanine-dinucleotide (bis-MGD) cofactor, facilitating reversible formate (HCOO-) to CO2 oxidation. We characterized the molecular structure of the active site of wildtype RcFDH and protein variants using X-ray absorption spectroscopy (XAS) at the Mo K-edge. This approach has revealed concomitant binding of a sulfido ligand (Mo=S) and a conserved cysteine residue (S(Cys386)) to Mo(VI) in the active oxidized molybdenum cofactor (Moco), retention of such a coordination motif at Mo(V) in a chemically reduced enzyme, and replacement of only the S(Cys386) ligand by an oxygen of formate upon Mo(IV) formation. The lack of a Mo=S bond in RcFDH expressed in the absence of FdsC implies specific metal sulfuration by this bis-MGD binding chaperone. This process still functioned in the Cys386Ser variant, showing no Mo-S(Cys386) ligand, but retaining a Mo=S bond. The C386S variant and the protein expressed without FdsC were inactive in formate oxidation, supporting that both Moligands are essential for catalysis. Low-pH inhibition of RcFDH was attributed to protonation at the conserved His387, supported by the enhanced activity of the His387Met variant at low pH, whereas inactive cofactor species showed sulfido-to-oxo group exchange at the Mo ion. Our results support that the sulfido and S(Cys386) ligands at Mo and a hydrogen-bonded network including His387 are crucial for positioning, deprotonation, and oxidation of formate during the reaction cycle of RcFDH.
'Tools' in public management
(2022)
Tools are methods or procedures, and thus operational patterns of action, applied in public administrations to solve standard problems. It is also possible to consider them as structured communication according to professional standards aiming at complexity reduction. Regularly, tools in management stem on a deductive-synoptic rationale offering a seemingly ‘objective’ decision basis. They have a strong formative influence on the organization, regularly also beyond the intended effects. The prominence of tools is sometimes confused with management as such, e.g. introducing tools is mistaken as equivalent to managing for a particular purpose. However, tools have to be closely and carefully managed regarding the objectives and purposes they should serve.
Both the seat of the German government and the capitol of queer German culture, Berlin has been that spatial nexus of politics, sexuality and gender, work and leisure that has enabled the development of multifarious sexual and gender identities. This has caused celebration and consternation among Germans and foreigners alike. Contemporary studies of urban homosexual space cite an erosion of its 'authenticity' when cities market homosexual space in order to attract tourists. My literary analysis shows that Berlin's homosexual male culture and space had already been subject to commoditisation in the Weimar period (1918-1933), when Berliners discovered marketing potential in the French slight la vice allemand [the German vice] - male homosexuality. This article's examination of Weimar Berlin's spatial binary as 'sexy space' and 'sexualised place' in literature by Klaus Mann and Curt Moreck engages with current debates in leisure studies on the gendering and sexing of geography and leisure. Central to this re-evaluation of leisure and tourism in Weimar Berlin is my discussion of flanerie: the figure of the flaneuse indicates that flanerie was not the lone dominion of heterosexual men. In the context of urban leisure and male homosexuality, I argue that Weimar Berlin consistently and successfully negotiated its dual function of sexy space (allowing self-fashioning for homosexual men in Berlin) and sexualised place (voyeurism and sexual exploration for Berlin's newcomers and tourists).
The fruit of Aristotelia chilensis is considered a "super fruit" due to its high concentration of polyphenols displaying exceptional antioxidant capacities ORAC. From maqui berries have been reported several anthocyanins and glycosylated flavonoids, those benefits increase the attention to restudy the plant. From the leaves of A. chilensis several indole alkaloids have been reported, we in addition to aristoteline, aristone, aristoquinoline and 3-fromylindole report the spectroscopic elucidation of 8-oxo-9-dehydromakomakine (1), hobartine (2) and a new alkaloid named 8-oxohobartine (3). Compound 1 to 3 did not show bactericidal activity against E. coli and S. aureus till 200 mu g.
Lobelia tupa, also called devil's tobacco, is a native plant from the center-south of Chile which has been used by the native people of Chile as a hallucinogenic and anesthetic plant. A new piperidine alkaloid, called pentylsedinine, which comprises five carbons in the side chain, was isolated from the aerial part of L. tupa, along with lobeline and lobelanidine. The structure was established on the basis of 1D and 2D NMR spectroscopy. While lobeline is a neutral antagonist at alpha 3 beta 2/alpha 3 beta 4 nAChR and alpha 7 nAChR, both lobelanidine and pentylsedinine act as partial agonists at nAChR
The spatial magnetic properties (Through-Space NMR Shieldings-TSNMRS) of already synthesized dehydro[n]annulenes of various ring size (from C-12 to C-20) have been computed, visualized as Isochemical Shielding Surfaces (ICSS) of various size and direction, and were examined subject to present (anti)aromaticity. For this purpose the thus quantified ring current effect of the macro cycles on proximate protons in proton NMR spectra was employed.
The paper investigates Tolkien’s narratives of decline through the lens of their classical ancestry. Narratives of decline are widespread in ancient culture, in both philosophical and literary discourses. They normally posit a gradual degradation (moral and ontological) from an idealized Golden Age, which went hand-in-hand with increasing detachment of gods from mortal affairs. Narratives of decline are also at the core of Tolkien’s mythology, constituting yet another underresearched aspect of classical influence on Tolkien. Such Classical narratives reverberate e.g. in Tolkien’s division of Arda’s history into ages, from an idealized First Age filled with Joy and Light to a Third Age, described as “Twilight Age (…) the first of the broken and changed world” (Letters 131). More generally, these narratives are related to Tolkien’s notorious perception of history as a “long defeat” (Letters 195) and to that “heart-racking sense of the vanished past” which pervades Tolkien’s works – the emotion which, in his words, moved him “supremely” and which he found “small difficulty in evoking” (Letters 91). The paper analyses the reception of narratives of decline in Tolkien’s legendarium, pointing out similarities but also contrasts and differences, with the aim to discuss some key patterns of (classical) reception in Tolkien’s theory and practice (‘renewal’, ‘accommodation’, ‘focalization’).
We discuss the dynamics of a condensate in a miniaturized electromagnetic trap formed above a microstructured substrate. Recent experiments have found that trap lifetimes get reduced when approaching the substrate because atoms couple to thermally excited near fields. The data agree quantitatively with our theory [Appl. Phys. B 69, 379 (1999)]. We focus on the decoherence of a quantum degenerate gas in a quasi-one-dimensional trap. Monte Carlo simulations indicate that atom interactions reduce the condensate decoherence rate. This is explained by a simple theory in terms of the suppression of long-wavelength excitations. We present preliminary simulation results for the adiabatic generation of dark solitons
Molecular excitons play a central role in processes of solar energy conversion, both natural and artificial. It is therefore no wonder that numerous experimental and theoretical investigations in the last decade, employing state-of-the-art spectroscopic techniques and computational methods, have been driven by the common aim to unravel exciton dynamics in multichromophoric systems. Theoretically, exciton (de)localization and transfer dynamics are most often modelled using either mixed quantum-classical approaches (e.g., trajectory surface hopping) or fully quantum mechanical treatments (either using model diabatic Hamiltonians or direct dynamics). Yet, the terms such as "exciton localization" or "exciton transfer" may bear different meanings in different works depending on the method in use (quantum-classical vs. fully quantum). Here, we relate different views on exciton (de)localization. For this purpose, we perform molecular surface hopping simulations on several tetracene dimers differing by a magnitude of exciton coupling and carry out quantum dynamical as well as surface hopping calculations on a relevant model system. The molecular surface hopping simulations are done using efficient long-range corrected time-dependent density functional tight binding electronic structure method, allowing us to gain insight into different regimes of exciton dynamics in the studied systems.
The ability to reflect is considered an essential element of Education for Sustainable Development (ESD) and a key competence for learners and educators in ESD (UNECE Strategy for ESD, 2012). In contrast to its high importance, little is known about how reflective thinking can be identified, influenced or increased in the classroom. Therefore, the objective of this study is to address this need by developing an empirical multi-stage model designed to help educators diagnose different levels of reflective thinking and to identify factors that influence students’ reflective thinking about sustainability. Based on a 4–8-week project with grade 10 and 11 students studying sustainability, reflective thinking performance using weblogs as reflective journals was analysed. In addition, qualitative semi-structured interviews were conducted with the teachers to comprehend the learning environment and the personal value they assigned to ESD in their geography class. To determine the levels of reflective thinking achieved by the students, the study built on the work of Dewey (1933) and pre-existing multi-stage models of reflective thinking (Bain, Ballantyne, & Packer, 1999; Chen, Wei, Wu, & Uden, 2009). Using a qualitative, iterative data analysis, the study adapted the stage models to be applicable in ESD and found great differences in the students’ reflection levels. Furthermore, the study identified eight factors that influence students’ reflective thinking about sustainability. The outcomes of this study may be valuable for educators in high school and higher education, who seek to diagnose their students’ reflective thinking performance and facilitate reflection about sustainability.
(Near-)inverses of sequences
(2006)
We introduce the notion of a near-inverse of a non-decreasing sequence of positive integers; near-inverses are intended to assume the role of inverses in cases when the latter cannot exist. We prove that the near-inverse of such a sequence is unique; moreover, the relation of being near-inverses of each other is symmetric, i.e. if sequence g is the near-inverse of sequence f, then f is the near-inverse of g. There is a connection, by approximations, between near- inverses of sequences and inverses of continuous strictly increasing real-valued functions which can be exploited to derive simple expressions for near-inverses
We present novel experimental evidence on the availability and the status of exhaustivity inferences with focus partitioning in German, English, and Hungarian. Results suggest that German and English focus-background clefts and Hungarian focus share important properties, (É. Kiss 1998, 1999; Szabolcsi 1994; Percus 1997; Onea & Beaver 2009). Those constructions are anaphoric devices triggering an existence presupposition. EXH-inferences are not obligatory in such constructions in English, German, or Hungarian, against some previous literature (Percus 1997; Büring & Križ 2013; É. Kiss 1998), but in line with pragmatic analyses of EXH-inferences in clefts (Horn 1981, 2016; Pollard & Yasavul 2016). The cross-linguistic differences in the distribution of EXH-inferences are attributed to properties of the Hungarian number marking system.
The Social War (91-88 BCE) is one of the most significant episodes in Roman history: from this war, in which Rome fought against her Italic allies, emerged the elite that would lead the Republic in the last decades of its existence and that would provide the senatorial aristocracy of the early imperial age. The Italic rebels were defeated militarily, yet they achieved their political aims. As such, this war – and its elaboration and memorialization in Roman cultural memory – provides a very interesting case study about how "victory" and "defeat" are constructed discursively after a disruptive war, and how its narration is "functionalized" for a re-foundation of the civic body.
We dissect the sources of error leading to inaccuracies in the description of the geometry and optical excitation energies of pi-conjugated polymers. While the ground-state bond length alternation is shown to be badly reproduced by standard functionals, the recently adapted functionals PBEh* and omega PBE* as well as the double hybrid functional XYGJ-OS manage to replicate results obtained at the CCSD(T) level. By analysis of the bond length alternation in the excited state, a sensitive dependence of the exciton localization on the long-range behavior of the functional and the amount of Hartree-Fock exchange present is shown. Introducing thermal disorder through molecular dynamics simulations allows the consideration of a range of thermally accessible configurations of each oligomer, including trans to cis rotations, which break the conjugation of the backbone. Thermal disorder has a considerable effect when combined with functionals that overestimate the delocalization of the excitation, such as B3LYP. For functionals with a larger amount of exact exchange such as our PBEh* and omega PBE*, however, the effect is small, as excitations are often localized enough to fit between twists in the chain.
1 + 2 is more than 2 + 1: Violations of commutativity and identity axioms in mental arithmetic
(2015)
Over the past decade or so, a large number of studies have revealed that conceptual meaning is sensitive to situational context. More recently, similar contextual influences have been documented in the domain of number knowledge. Here we show such context dependency in a length production task. Adult participants saw single digit addition problems of the form n1 + n2 and produced the sum by changing bi-directionally the length of a horizontally extended line, using radially arranged buttons. We found that longer lines were produced when n1 < n2 compared to n1 > n2 and that unit size increased with result size. Thus, the mathematical axioms of commutativity and identity do not seem to hold in mental addition. We discuss implications of these observations for our understanding of cognitive mechanisms involved in mental arithmetic and for situated cognition generally.
A series of new N2S2 mixed ligand transition metal complexes, where N-2 is phenanthroline and S-2 is 1,2- dithiooxalate (dto) or 1,2-dithiosquarate (dtsq), has been synthesized and characterized. IR spectra reveal that the 1,2- dithiolate ligands are coordinated via the sulfur atoms forming a N2S2 coordination sphere. The copper(II) complex [Cu(phen)(dto)] was studied by EPR spectroscopy as a diamagnetically diluted powder. The diamagnetic dilution resulted from doping of the copper complex into the isostructural host lattice of the nickel complex [Ni(phen)(dto)]. The electronic situation in the frontier orbitals of the copper complex calculated from the experimental data is compared to the results of EHT and DFT calculations. Furthermore, one side product, chlorobis(1,10-phenanthroline)copper(I) ethanol solvate hydrate [(phen)(2)CuCl]center dot C2H5OH center dot H2O, was formed by a reduction process and characterized by X-ray diffraction. In the crystal packing one-dimensional columns of dimers are formed, stabilized by significant pi-pi interactions.
A series of new monocationic iridium(III) complexes [Ir((CN)-N-boolean AND)(2)((NN)-N-boolean AND)]PF6 with "large-surface" alpha,alpha'-diimin ligands (NN)-N-boolean AND (dap = 1,12-diazaperylene, dmedap = 2,11-dimethyl-1,12-diazaperylene, dipdap = 2,11-diisopropyl-1,12-diazaperylene) and different cyclometalating ligands (CN)-N-boolean AND (piq = 1-phenylisoquinoline, bzq = benzo[h]quinoline, ppz = 1-phenylpyrazole, thpy = 2-(2-thienyl)pyridine, ppy = 2-phenylpyridine, meppy = 2-(4-methylphenyl)pyridine, dfppy = 2-(2,4-difluorophenyl)pyridine) were synthesized. The solid structures of the complexes [Ir(piq)(2)(dap)]PF6, [Ir(bzq)(2)(dap)]PF6, [Ir(ppy)(2)(dipdap)]PF6, [Ir(piq)(2)(dmedap)]PF6, [Ir(ppy)(2)(dap)]PF6 and [Ir(ppz)(2)(dap)]PF6 are reported. In [Ir(piq)(2)(dap)]PF6, the dap ligand and one of the piq ligands of each cationic complex are involved in pi-pi stacking interactions forming supramolecular channels running along the crystallographic c axis. In the crystalline [Ir(bzq)(2)(dap)]PF6 pi-pi stacking interactions between the metal complexes lead to the formation of a 2D layer structure. In addition, CH-pi interactions were found in all compounds, which are what stabilizes the solid structure. In particular, a significant number of them were found in [Ir(piq)(2)(dap)]PF6 and [Ir(bzq)(2)(dap)]PF6. The crystal structures of [Ir(ppy)(2)(dipdap)]PF6 and [Ir(ppy)(2)(dmedap)]PF6 are also presented, being the first examples of bis-cyclometalated iridium(III) complexes with phenanthroline-type alpha,alpha'-diimin ligands bearing bulky alkyl groups in the neighbourhood of the N-donor atoms. These ligands implicate a distorted octahedral coordination geometry that in turn destabilized the Ir-N-N boolean AND N bonds. The new iridium (III) complexes are not luminescent. All compounds show an electrochemically irreversible anodic peak between 1.15 and 1.58 V, which is influenced by the different cyclometalated ligands. All of the new complexes show two reversible successive one-electron "large-surface" ligand-centred reductions around -0.70 V and -1.30 V. Electrospray ionisation mass spectrometry (ESI-MS) and collision induced decomposition (CID) measurements were used to investigate the stability of the new complexes. Thereby, the stability agreed well with the order of the Ir-N-N boolean AND N bond lengths.
Herein, we represent cation-responsive fluorescent probes for the divalent cations Zn2+, Mg2+ and Ca2+, which show cation-induced fluorescence enhancements (FE) in water. The Zn2+-responsive probes Zn1, Zn2, Zn3 and Zn4 are based on o-aminoanisole-N,N-diacetic acid (AADA) derivatives and show in the presence of Zn2+ FE factors of 11.4, 13.9, 6.1 and 8.2, respectively. Most of all, Zn1 and Zn2 show higher Zn2+ induced FE than the regioisomeric triazole linked fluorescent probes Zn3 and Zn4, respectively. In this set, ZN2 is the most suitable probe to detect extracellular Zn2+ levels. For the Mg2+-responsive fluorescent probes Mg1, Mg2 and Mg3 based on o-aminophenol-N,N,O-triacetic acid (APTRA) derivatives, we also found that the regioisomeric linkage influences the fluorescence responds towards Mg2+ (Mg1+100 mM Mg2+ (FEF=13.2) and Mg3+100 mM Mg2+ (FEF=2.1)). Mg2 shows the highest Mg2+-induced FE by a factor of 25.7 and an appropriate K-d value of 3 mM to measure intracellular Mg2+ levels. Further, the Ca2+-responsive fluorescent probes Ca1 and Ca2 equipped with a 1,2-bis(o-aminophenoxy)ethane-N,N,N',N'-tetraacetic acid (BAPTA) derivative show high Ca2+-induced FEs (Ca1 (FEF=22.1) and Ca2 (FEF=23.0)). Herein, only Ca1 (K-d=313 nM) is a suitable Ca2+ fluorescent indicator to determine intracellular Ca2+ levels.
Background and objective Whether treatment with vitamin D receptor activators contributes to cardiovascular disease in patients with chronic kidney disease is a matter of debate. We studied mechanisms involved in vitamin D-related vascular calcifications in vivo and in vitro.
Methods Aortic calcifications were induced in subtotally nephrectomized (SNX) rats by treatment with a high dose (0.25 mu g/kg per day) of 1,25-dihydroxyvitamin D-3 (calcitriol) given for 6 weeks. Likewise, primary rat vascular smooth muscle cells (VSMCs) were incubated with calcitriol at concentrations ranging from 10(-11) to 10(-7) mol/l. Immunohistochemistry revealed that the aortic expression of osteopontin, osteocalcin and bone sialoprotein was significantly increased in calcitriol-treated SNX rats compared to untreated SNX controls. In addition, aortic expression of the transient receptor potential vanilloid calcium channel 6 (TRPV6) and calbindin D9k was significantly up-regulated by treatment with calcitriol. Furthermore, calcitriol significantly increased expression of the osteogenic transcription factor osterix. In-vitro studies showed similar results, confirming that these effects could be attributed to treatment with calcitriol.
Conclusions High-dose calcitriol treatment induces an osteoblastic phenotype in VSMC both in SNX rats and in vitro, associated with up-regulation of proteins regulating mineralization and calcium transport, and of the osteogenic transcription factor osterix.
The first Si-H-containing azasilaheterocycle, 1,3-dimethyl-3-silapiperidine 1, was synthesized, and its molecular structure and conformational properties were studied by gas-phase electron diffraction (GED), low temperature NMR, IR and Raman spectroscopy and quantum chemical calculations. The compound exists as a mixture of two conformers possessing the chair conformation with the equatorial NMe group and differing by axial or equatorial position of the SiMe group. In the gas phase, the SiMeax conformer predominates (GED: ax/eq = 65(7):35(7)%,Delta G = 0.36(18) kcal/mol; IR: ax/eq = 62(5):38(5)%,Delta G = 0.16(7) kcal/mol). In solution, at 143 k the SiMeeq conformer predominates' in the frozen equilibrium (NMR: ax/eq = 31.5(1.5):68.5(1.5)%, Delta G = -0.22(2) kcal/mol). Thermodynamic parameters of the ring inversion are determined (Delta G(double dagger) = 8.9-9.0 kcal/mol, Delta H-double dagger = 9.6 kcal/mol, Delta S-double dagger = 2.1 eu). High-level quantum chemical calculations :(MP2, G2, CCSD(T)) nicely reproduce the experimental geometry and the predominance of the axial conformer in the gas phase.
We previously showed that purified 1-methoxy-3-indolylmethyl (1-MIM) glucosinolate, a secondary plant metabolite in Brassica species, is mutagenic in various in vitro systems and forms DNA and protein adducts in mouse models. In the present study, we administered 1-MIM glucosinolate in a natural matrix to mice, by feeding a diet containing pak choi powder and extract. Groups of animals were killed after 1, 2, 4 and 8 days of pak choi diet, directly or, in the case of the 8-day treatment, after 0, 8 and 16 days of recovery with pak choi-free diet. DNA adducts [N-2-(1-MIM)-dG, N-6-(1-MIM)-dA] in six tissues, as well as protein adducts [tau N-(1-MIM)-His] in serum albumin (SA) and hemoglobin (Hb) were determined using UPLC-MS/MS with isotopically labeled internal standards. None of the samples from the 12 control animals under standard diet contained any 1-MIM adducts. All groups receiving pak choi diet showed DNA adducts in all six tissues (exception: lung of mice treated for a single day) as well as SA and Hb adducts. During the feeding period, all adduct levels continuously increased until day 8 (in the jejunum until day 4). During the 14-day recovery period, N-2-(1-MIM)-dG in liver, kidney, lung, jejunum, cecum and colon decreased to 52, 41, 59, 11, 7 and 2%, respectively, of the peak level. The time course of N-6-(1-MIM)-dA was similar. Immunohistochemical analyses indicated that cell turnover is a major mechanism of DNA adduct elimination in the intestine. In the same recovery period, protein adducts decreased more rapidly in SA than in Hb, to 0.7 and 37%, respectively, of the peak level, consistent with the differential turnover of these proteins. In conclusion, the pak choi diet lead to the formation of high levels of adducts in mice. Cell and protein turnover was a major mechanism of adduct elimination, at least in gut and blood.
1-Methylthio-1-phenyl-1-silacyclohexane 1, the first silacyclohexane with the sulfur atom at silicon, was synthesized and its molecular structure and conformational preferences studied by gas-phase electron diffraction (GED) and low temperature C-13 and Si-29 NMR spectroscopy (LT NMR). Quantum-chemical calculations were carried out both for the isolated species and solvate complexes in gas and in polar medium. The predominance of the 1-MeSaxPheq conformer in gas phase (1-Ph-eq :1-Ph-ax = 55:45, Delta G degrees = 0.13 kcal/mol) determined from GED is consistent with that measured in the freon solution by LT NMR (1-Ph-eq:1-Ph-ax = 65:35, Delta G degrees = 0.12 kcal/mol), the experimentally measured ratios being close to that estimated by quantum chemical calculations at both the DFT and MP2 levels of theory. (C) 2019 Elsevier Ltd. All rights reserved.
1-Oxo-1,3-dithiolane (4) and its cis- and trans-2-methyl (5,6), -4-methyl (7,8) and -5-methyl (9,10) derivatives were prepared by oxidizing the corresponding 1,3-dithiolanes (1-3) with NaIO(4) in water. The oxides were purified and their isomers separated using thin layer chromatography. The structural characterization was carried out with (1)H and (13)C NMR spectroscopy and molecular modelling. The sulfoxides 4-6 and 8-10 attain two S(1) type envelopes (sometimes slightly distorted) the S=O(ax) envelope greatly dominating. Cis-4-methyl-1-oxo-1,3-dithiolane is a special case exhibiting both two closely related S=O(ax) (30 and 27%) as well as S=O(eq) (21 and 22%) forms [S(1) and C(4) envelopes, respectively]. The relative energies of these conformations, the values of (1)H-(1)H coupling constants and (1)H and (13)C chemical shifts were estimated by computational methods and they support well the conclusions based on the experimental data.