Search results for "Theoretical Chemistry"

showing 10 items of 8456 documents

A new resonant Laser-SNMS system for environmental ultra-trace analysis: Installation and optimization

2017

Abstract Localization, analysis and mobility of radioactive contaminated particles is of major concern for assessment of contamination threads and nuclear forensics. For this purpose, a new resonant Laser-SNMS system was developed and set up at the Institute for Radioecology and Radiation Protection for spatially resolved ultra-trace analysis of low concentrated radionuclides directly on environmental samples. This paper describes the adaption and combination of a dedicated Ti:sapphire laser system with a commercial TOF-SIMS instrument for resonant Laser-SNMS. The project includes computer simulations for optimization of the TOF analyzer. Results on synthetic uranium and technetium samples …

medicine.medical_specialtySpectrum analyzerNuclear forensicsNuclear engineeringchemistry.chemical_elementNanotechnology01 natural scienceslaw.inventionRadioecologylaw0103 physical sciencesmedicinePhysical and Theoretical Chemistry010306 general physicsInstrumentationSpectroscopyRadionuclideChemistrybusiness.industry010401 analytical chemistryUraniumContaminationCondensed Matter PhysicsLaser0104 chemical sciencesRadiation protectionbusinessInternational Journal of Mass Spectrometry
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Systemic Review: Ozone: A Potential New Chemotherapy

2021

In the last sixty years, publications in reputed journals have shown the preclinical positive effect of ozone gas in cancer cells. However, the translation of these results into clinical practice is far away from success. A comprehensive approach is necessary for this, and oncologists and researchers need guidance from medical specialists with in-depth knowledge of ozone in medicine. In this article, we review the evidence around this question and suggest different potential research lines to those interested in this exciting field.

medicine.medical_specialtybusiness.industryQH301-705.5Organic ChemistryGeneral MedicineReviewOzone therapyCatalysisComputer Science ApplicationsInorganic ChemistryClinical PracticeChemistryOzoneoncologyMedicineHumanscancerPhysical and Theoretical ChemistryBiology (General)businessIntensive care medicineMolecular BiologyQD1-999Spectroscopyozone therapyInternational Journal of Molecular Sciences
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Ultraviolet B Irradiation Modulates the Immune System of Fish (Rutilus rutilus, Cyprinidae) II: Blood

2007

The effects of a single dose of ultraviolet B (UVB) radiation (0.4 J/cm2) on immunological functions by blood leukocytes and on hematological parameters was studied in roach (Rutilus rutilus), a teleostean fish. The respiratory burst of phorbol 12-myristate 13-acetate stimulated whole blood phagocytes increased significantly after UVB irradiation but spontaneous cytotoxicity of blood leukocytes toward 51chromium-labeled K562 target cells was not markedly altered. Differential cell counting revealed that UVB exposure significantly increased the proportion of granulocytes and significantly decreased the proportion of lymphocytes in the peripheral blood, whereas hematocrit and the total number…

medicine.medical_specialtyintegumentary systemmedicine.diagnostic_testGeneral MedicineHematocritBiologyCell countingbiology.organism_classificationBiochemistryRespiratory burstchemistry.chemical_compoundEndocrinologyImmune systemchemistryInternal medicineImmunologymedicinePhorbolPhysical and Theoretical ChemistryRutilusCytotoxicityWhole bloodPhotochemistry and Photobiology
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Smoking and Neuropsychiatric Disease-Associations and Underlying Mechanisms.

2021

Despite extensive efforts to combat cigarette smoking/tobacco use, it still remains a leading cause of global morbidity and mortality, killing more than eight million people each year. While tobacco smoking is a major risk factor for non-communicable diseases related to the four main groups—cardiovascular disease, cancer, chronic lung disease, and diabetes—its impact on neuropsychiatric risk is rather elusive. The aim of this review article is to emphasize the importance of smoking as a potential risk factor for neuropsychiatric disease and to identify central pathophysiological mechanisms that may contribute to this relationship. There is strong evidence from epidemiological and experiment…

medicine.medical_specialtyneuropsychiatric disorder ; smoking ; smoking-induced disease ; inflammation ; oxidative stressQH301-705.5DiseaseReviewCatalysisInorganic Chemistry03 medical and health sciences0302 clinical medicineRisk FactorsEpidemiologymedicineTobacco SmokingDementiaAnimalsHumans030212 general & internal medicinePhysical and Theoretical ChemistryCognitive declineRisk factorBiology (General)PsychiatryMolecular BiologyQD1-999SpectroscopyDepression (differential diagnoses)business.industryOrganic ChemistrySmokingsmoking-induced diseaseneuropsychiatric disorderGeneral Medicinemedicine.diseaseAnxiety DisordersComputer Science ApplicationsChemistryOxidative StressSchizophreniainflammationbusiness030217 neurology & neurosurgeryAnxiety disorderSignal TransductionInternational journal of molecular sciences
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The Potential Use of Resveratrol for Cancer Prevention.

2019

In addition to the traditional treatments of cancer and cancer prevention, the use of natural compounds, especially those found in food, should be considered. To clarify if resveratrol has the potential for cancer prevention and the possibility of use in therapy, the following must be taken into account: data from epidemiology, clinical protocol (case and control), preclinical studies (lab animals), use of established cell lines as models of cancer cells, test tube assays (enzymes activities), and requirements of nanotechnologies in order to discover new drugs to fight cancer. From this perspective and future expected advances, more information is needed such as improved efficacy, methods o…

medicine.medical_treatmentDrug Evaluation PreclinicalPharmaceutical ScienceReviewResveratrolresveratrolBioinformaticsChemopreventionAnalytical Chemistry03 medical and health scienceschemistry.chemical_compound0302 clinical medicinepreventionNeoplasmsDrug DiscoverymedicineAnimalsHumanscancerPhysical and Theoretical ChemistrySensitization030304 developmental biology0303 health sciencesmechanismsCancer preventionbusiness.industryOrganic ChemistryClinical Studies as TopicCancerDisease Managementmedicine.diseaseAntineoplastic Agents PhytogenicBioavailabilitymedicine.anatomical_structurechemistryChemistry (miscellaneous)030220 oncology & carcinogenesisapproach strategiesCancer cellMolecular MedicineDisease Susceptibilitybusinessinnovative formulationsAdjuvantSignal TransductionMolecules (Basel, Switzerland)
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2021

Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) is the causative agent for the COVID-19 pandemic, which generated more than 1.82 million deaths in 2020 alone, in addition to 83.8 million infections. Currently, there is no antiviral medication to treat COVID-19. In the search for drug leads, marine-derived metabolites are reported here as prospective SARS-CoV-2 inhibitors. Two hundred and twenty-seven terpene natural products isolated from the biodiverse Red-Sea ecosystem were screened for inhibitor activity against the SARS-CoV-2 main protease (Mpro) using molecular docking and molecular dynamics (MD) simulations combined with molecular mechanics/generalized Born surface area b…

medicine.medical_treatmentMetaboliteIn silicoPharmaceutical SciencePharmacology01 natural sciencesMolecular mechanicsAnalytical Chemistry03 medical and health scienceschemistry.chemical_compoundDrug DiscoverymedicineProtease inhibitor (pharmacology)Physical and Theoretical ChemistryBinding site030304 developmental biology0303 health sciencesProteaseDrug discoveryOrganic ChemistryLopinavir0104 chemical sciences010404 medicinal & biomolecular chemistrychemistryChemistry (miscellaneous)Molecular Medicinemedicine.drugMolecules
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Encapsulation of Vitamins A and E as Spray-Dried Additives for the Feed Industry

2020

Encapsulated fat-soluble powders containing vitamin A (VA) and E (VE) were prepared as a feasible additive for extruded feed products. The effect of the encapsulating agents (Capsul-CAP&reg

medicine.medical_treatmentPharmaceutical Science02 engineering and technologyAnalytical Chemistrychemistry.chemical_compoundSpectroscopy Fourier Transform InfraredDrug DiscoveryVitamin E03.- Garantizar una vida saludable y promover el bienestar para todos y todas en todas las edadesVitamin ACalorimetry Differential ScanningTemperatureSpray Drying04 agricultural and veterinary sciences021001 nanoscience & nanotechnologyMaltodextrin040401 food science02.- Poner fin al hambre conseguir la seguridad alimentaria y una mejor nutrición y promover la agricultura sostenibleChemistry (miscellaneous)Spray dryingThermogravimetryMAQUINAS Y MOTORES TERMICOSMolecular MedicineEmulsionsExtrusionPowders0210 nano-technologyOxidation-ReductionPorosityMaterials scienceNanoemulsionsDrug CompoundingSodiumChemical structureSpray-dryingchemistry.chemical_elementArticle14.- Conservar y utilizar de forma sostenible los océanos mares y recursos marinos para lograr el desarrollo sosteniblelcsh:QD241-4410404 agricultural biotechnologylcsh:Organic chemistrymedicineThermal stabilityParticle SizePhysical and Theoretical ChemistryPorosityVitamin EOrganic ChemistryHumidityChemical engineeringchemistryDietary SupplementsNanoparticlesEncapsulationMolecules
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Cannabidiol Treatment Might Promote Resilience to Cocaine and Methamphetamine Use Disorders: A Review of Possible Mechanisms

2019

Currently, there are no approved pharmacotherapies for addiction to cocaine and other psychostimulant drugs. Several studies have proposed that cannabidiol (CBD) could be a promising treatment for substance use disorders. In the present work, the authors describe the scarce preclinical and human research about the actions of CBD on the effects of stimulant drugs, mainly cocaine and methamphetamine (METH). Additionally, the possible mechanisms underlying the therapeutic potential of CBD on stimulant use disorders are reviewed. CBD has reversed toxicity and seizures induced by cocaine, behavioural sensitization induced by amphetamines, motivation to self-administer cocaine and METH, context- …

medicine.medical_treatmentPharmaceutical ScienceCravingReviewPharmacologyAnalytical ChemistryHealth Risk Behaviorschemistry.chemical_compoundcannabidiol0302 clinical medicineDrug DiscoveryMedicineratrewardmedia_commonResilience PsychologicalMethamphetamineconditioned place preferenceSubstance Withdrawal SyndromeObservational Studies as TopicChemistry (miscellaneous)Molecular Medicineaddictionmedicine.symptomSelf-administrationself-administrationmedicine.drugmicemedia_common.quotation_subjectAmphetamine-Related DisorderscocaineContext (language use)lcsh:QD241-441Cocaine-Related Disorders03 medical and health scienceslcsh:Organic chemistryAnimalsHumansPhysical and Theoretical Chemistrymethamphetaminebusiness.industryAddictionOrganic ChemistryMeth-Conditioned place preferencedigestive system diseasesreinstatement030227 psychiatryStimulantchemistrybusiness030217 neurology & neurosurgeryMolecules
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Inorganic Mercury Sequestration by a Poly(ethylene imine) Dendrimer in Aqueous Solution

2015

The interaction of the G-2 poly(ethylene imine) dendrimer L, derived from ammonia as initiating core, with Hg(II) and HgCl4 2− was studied in aqueous solution by means of potentiometric (pH-metric) measurements. Speciation of these complex systems showed that L is able to form a wide variety of complexes including 1:1, 2:1, 3:1 and 3:2 metal-to-ligand species, of different protonation states, as well as the anion complexes ((H7L)HgCl4) 5+ and ((H8L)HgCl4) 6+ . The stability of the metal complexes is very high, making L an excellent sequestering agent for Hg(II), over a large pH range, and a promising ligand for the preparation of functionalized activated carbons to be employed in the remedi…

mercuryImineInorganic chemistryPotentiometric titrationPharmaceutical Sciencechemistry.chemical_elementProtonationmercury dendrimers sequestration water contamination environmentArticleAnalytical Chemistrydendrimerspoly(ethylene imine)Metallcsh:QD241-441chemistry.chemical_compoundAmmoniacontaminationlcsh:Organic chemistryDendrimerDrug DiscoveryremediationPhysical and Theoretical ChemistryAqueous solutionMolecular StructureOrganic ChemistryMercury (element)chemistryChemistry (miscellaneous)visual_artPotentiometryvisual_art.visual_art_mediumMolecular MedicineEnvironmental PollutantsIminesPolyethylenesMolecules
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Fecal Metagenomics and Metabolomics Identifying Microbial Signatures in Non-Alcoholic Fatty Liver Disease

2023

The frequency of non-alcoholic fatty liver disease (NAFLD) has intensified, creating diagnostic challenges and increasing the need for reliable non-invasive diagnostic tools. Due to the importance of the gut–liver axis in the progression of NAFLD, studies attempt to reveal microbial signatures in NAFLD, evaluate them as diagnostic biomarkers, and to predict disease progression. The gut microbiome affects human physiology by processing the ingested food into bioactive metabolites. These molecules can penetrate the portal vein and the liver to promote or prevent hepatic fat accumulation. Here, the findings of human fecal metagenomic and metabolomic studies relating to NAFLD are reviewed. The …

metagenomicsgut microbiotasuolistomikrobistoOrganic Chemistryrasvamaksamaksaendocrinology_metabolomicsGeneral Medicineliver fatmetabolomicsCatalysisComputer Science ApplicationsInorganic ChemistryNAFLDmetabolic pathwaysPhysical and Theoretical ChemistrydietMolecular BiologyaineenvaihduntaSpectroscopy
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