Search results for "Activity"

showing 10 items of 7178 documents

Synthesis and selected properties of metallo and metal-free 2,3,9,10,16,17,23,24-octacarboxyphthalocyanines

2015

This review article reports methods of synthe sis and selected physicochemical properties of metallo and metal-free 2,3,9,10,16,17,23,24–octacarboxyphthalocyanines. The most frequently used methods of synthesis for this class of co mpounds are described in this article. Moreover, aggregation, catalytic and photocatalytic properties of these complexes are presented. Potential applications of metallo and metal-free 2,3,9,10,16,17,23,24–octacarboxyphthalocyanines are also given.

synthesisabsorption spectraapplicationsChemistry3Organic Chemistryaggregation1724-octacarboxyphthalocyanines16Combinatorial chemistry10Catalysis23catalytic and photocatalytic activitylcsh:QD241-441Metal freelcsh:Organic chemistryPhotocatalysismetallo and metal-free 29ARKIVOC : Archive for Organic Chemistry
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Synthesis and Structure-Affinity Relationships of Spirocyclic Benzopyrans with Exocyclic Amino Moiety

2019

σ1 and/or σ2 receptors play a crucial role in pathological conditions such as pain, neurodegenerative disorders, and cancer. A set of spirocyclic cyclohexanes with diverse O-heterocycles and amino moieties (general structure III) was prepared and pharmacologically evaluated. In structure-activity relationships studies, the σ1 receptor affinity and σ1:σ2 selectivity were correlated with the stereochemistry, the kind and substitution pattern of the O-heterocycle, and the substituents at the exocyclic amino moiety. cis-configured 2-benzopyran cis-11b bearing a methoxy group and a tertiary cyclohexylmethylamino moiety showed the highest σ1 affinity ( Ki = 1.9 nM) of this series of compounds. In…

synthesisexocyclic amino moietyReceptors Opioid mudocking studieCrystallography X-RayLigands01 natural sciencesopioid receptorschemistry.chemical_compoundProtein structureDrug DiscoveryMoiety0303 health sciencesσ1 receptor ligandsstructure (σ1) affinity relationshipmolecular dynamicBenzyl groupMolecular MedicinesynthesiBenzopyransSelectivityHydrophobic and Hydrophilic Interactionsfree binding enthalpyStereochemistrychange of receptor profileMolecular Dynamics Simulation03 medical and health sciencesStructure-Activity Relationshipσ1 receptor ligands; spirocyclic compounds; benzopyrans; benzofurans; exocyclic amino moiety; synthesis; structure (σ1) affinity relationships; σ1 antagonistic activity; receptor selectivity; molecular dynamics; docking studies; free binding enthalpy; X-ray crystal structure; opioid receptors; MOR affinity; change of receptor profile; structure MOR affinity relationshipsstructure (σ1) affinity relationshipsStructure–activity relationshipHumansReceptors sigmaBenzopyransSpiro Compoundsspirocyclic compoundBinding siteMOR affinity030304 developmental biologybenzopyranbenzofuransσ1 receptor ligandBinding Sitesspirocyclic compoundsreceptor selectivitystructure MOR affinity relationshipsdocking studiesbenzofuranopioid receptorX-ray crystal structuremolecular dynamics0104 chemical sciencesProtein Structure Tertiary010404 medicinal & biomolecular chemistrychemistrySalt bridgeσ1 antagonistic activity
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Systematic conformational search analysis of the SRR and RRR epimers of 7-hydroxymatairesinol

2010

An extensive and systematic conformational search was performed on the two epimers of the natural lignan 7-hydroxymatairesinol (HMR), by means of a home-made Systematic Conformational Search Analysis (SCSA) code, designed to select more and more stable conformers through sequential geometry optimization of trial structures at increasing levels of calculation theory. In the present case, the starting molecular structures were selected by the semi-empirical AM1 method and filtered – i.e. decreased in number by choosing the more stable species – on the basis of their energy calculated by the HF method and the 6-31G(d) basis set. The geometries obtained were further refined by performing densit…

systematic conformational search analysiSettore CHIM/03 - Chimica Generale E Inorganica7-hydroxymatairesinol quantum chemical studyDFT calculationstructure–reactivity relationship
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Priorities and gaps in Mediterranean bat research evidence: a systematic review for the early twenty-first century

2022

Bat conservation is one of the top global concerns for research today; however, conservation efforts may still be limited and impotent due to inadequacy and scarcity of data. Hence, identifying research trends, threatening factors, species status, and geographical priorities is an essential tool for future conservation, protection and prioritization. Here we conduct a comprehensive systematic review to identify current research priorities, trends, general patterns and gaps regarding Mediterranean bat researches. A total of 97 studies were found in the years spanning between 2000 and 2021. There were 18 studies with sufficient data for qualitative statistical analysis to investigate the impa…

systematic review ecology Mediterranean basin conservation Chiroptera. bat activity
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Transcranial Alternating Current Stimulation (tACS) Does Not Affect Sports People’s Explosive Power: A Pilot Study

2021

Purpose: This study is aimed to preliminary investigate whether transcranial alternating current stimulation (tACS) could affect explosive power considering genetic background in sport subjects.Methods: Seventeen healthy sports volunteers with at least 3 years of sports activities participated in the experiment. After 2 weeks of familiarization performed without any stimulation, each participant received either 50 Hz-tACS or sham-tACS. Before and after stimulation, subjects performed the following tests: (1) the squat jump with the hands on the hips (SJ); (2) countermovement jump with the hands on the hips (CMJ); (3) countermovement jump with arm swing (CMJ-AS); (4) 15-s Bosco’s test; (5) s…

tACSmedicine.medical_specialtybrain stimulationNeurosciences. Biological psychiatry. NeuropsychiatryAffect (psychology)polymorphism03 medical and health sciencesBehavioral Neuroscience0302 clinical medicinePhysical medicine and rehabilitationmotor cortexSquat jumpsport performancemedicineSports activityACEBiological PsychiatryOriginal Research030304 developmental biologyTranscranial alternating current stimulation0303 health sciencesbusiness.industryHuman NeurosciencePsychiatry and Mental healthBDNFNeuropsychology and Physiological PsychologyNeurologyArm swingBrain stimulationCountermovement jumpbusinesshuman activities030217 neurology & neurosurgeryRC321-571Explosive powerFrontiers in Human Neuroscience
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Activity Theory as a Lens to Identify Challenges in Surgical Skills Training at Hospital Work Environment

2015

In this paper the concepts from activity theory (AT) are applied for identifying the challenges and contradictions emerging in surgical resident’s curriculum based training at hospital. AT is utilised as a lens to identify contradictions that cause disturbances, problems, ruptures, breakdowns, and clashes which emerge while surgical skills training is implemented in a new way at hospital. We especially aim at finding solutions for contradictions which emerge while the new and old working culture are confronted and the workers are required to balance themselves between the patient care demands and workplace learning requirements. We are using the conceptual theoretical approach to describe…

ta113Medical educationKnowledge managementbusiness.industryeducationsurgical skills trainingActivity theoryTraining (civil)humanitiesPatient careWork environmentsurgical simulatorWorkplace learningexpertise developmentPhenomenonSurgical skillsta516businessPsychologyactivity theoryCurriculumta217
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Exploiting ongoing EEG with multilinear partial least squares during free-listening to music

2016

During real-world experiences, determining the stimulus-relevant brain activity is excitingly attractive and is very challenging, particularly in electroencephalography. Here, spectrograms of ongoing electroencephalogram (EEG) of one participant constructed a third-order tensor with three factors of time, frequency and space; and the stimulus data consisting of acoustical features derived from the naturalistic and continuous music formulated a matrix with two factors of time and the number of features. Thus, the multilinear partial least squares (PLS) conforming to the canonical polyadic (CP) model was performed on the tensor and the matrix for decomposing the ongoing EEG. Consequently, we …

ta113Multilinear mapmedicine.diagnostic_testBrain activity and meditationSpeech recognition02 engineering and technologyElectroencephalographyta3112Matrix decomposition03 medical and health sciences0302 clinical medicinetensor decompositionFrequency domainPartial least squares regression0202 electrical engineering electronic engineering information engineeringmedicineSpectrogramOngoing EEG020201 artificial intelligence & image processingmusicTime domain030217 neurology & neurosurgerymultilinear partial least squaresMathematics
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Assessing game experience: Heart rate variability, in-game behavior and self-report measures

2014

Assessing game experience by means of recordings of physiological reactions elicited during game play is a technique that has gained popularity in recent years in the field of digital games research. However, since physiological signals are typically linked to several psychological processes, the use of some measures such as cardiac activity or heart rate (HR) remains problematic. The goal of the present study is to investigate to what extent game logs and self-report measures of game experience have a predictive value for heart rate variability during game play. Our results showed that the accurate registration of in-game behaviors by means of game logs carries the potential of providing r…

ta113MultimediaComputer scienceComputingMilieux_PERSONALCOMPUTINGCardiac activityGame playcomputer.software_genrePredictive valuePopularitySelf-report studyHeart rate variabilityta516human activitiescomputerCognitive psychology
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Force Distribution Analysis of Mechanochemically Reactive Dimethylcyclobutene

2013

Internal molecular forces can guide chemical reactions, yet are not straightforwardly accessible within a quantum mechanical description of the reacting molecules. Here, we present a force-matching force distribution analysis (FM-FDA) to analyze internal forces in molecules. We simulated the ring opening of trans-3,4-dimethylcyclobutene (tDCB) with on-the-fly semiempirical molecular dynamics. The self-consistent density functional tight binding (SCC-DFTB) method accurately described the force-dependent ring-opening kinetics of tDCB, showing quantitative agreement with both experimental and computational data at higher levels. Mechanical force was applied in two different ways, namely, exter…

ta114CyclobuteneChemistryMolecular ConformationMolecular Dynamics SimulationRing (chemistry)Atomic and Molecular Physics and Optics:Science::Biological sciences::Biophysics [DRNTU]chemistry.chemical_compoundMolecular dynamicsAccelerationTight bindingIsomerismComputational chemistryChemical physicsMechanochemistryQuantum TheoryMoleculeReactivity (chemistry)Physical and Theoretical Chemistryta116CyclobutanesChemPhysChem
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Reconsidering passivity and activity in children’s digital play

2016

The discussion around children’s digital game culture has resulted in two contradictory images of children: the passive, antisocial children uncritically and mechanically consuming digital game content and the active, social children creatively using and interacting with digital game content. Our aim is to examine how these seemingly contradictory ideas of “active” and “passive” children could be considered. By means of empirical examples of children playing digital dress-up and makeover games, we will point out that for the successful use of these concepts, they need to be thoroughly contextualized. By discussing the context and referent of activity and passivity, it is possible to overcom…

ta520aktiivisuusSociology and Political SciencePassivity050801 communication & media studiesContext (language use)Referent0508 media and communicationsdiskurssi0501 psychology and cognitive sciencespassivityta518Content (Freudian dream analysis)lapsetchildhoodPoint (typography)Communicationactivity05 social sciencesPolarization (politics)ComputingMilieux_PERSONALCOMPUTINGlapsuusdigital playdiscoursePsychologypassiivisuusSocial psychologyverkkopelitdigitaaliset pelit050104 developmental & child psychologyCognitive psychology
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