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Authors = Michael Kiselev

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14 pages, 1165 KiB  
Article
Predictors of Youth Accessibility for a Mobile Phone-Based Life Skills Training Program for Addiction Prevention
by Severin Haug, Nikolaos Boumparis, Andreas Wenger, Michael Patrick Schaub and Nikolai Kiselev
Int. J. Environ. Res. Public Health 2023, 20(14), 6379; https://doi.org/10.3390/ijerph20146379 - 17 Jul 2023
Cited by 5 | Viewed by 2134
Abstract
Background: Digital interventions are an emerging and promising avenue for addiction prevention and mental health promotion, but their reach and use are often limited, and little is known about the factors associated with youth accessibility. SmartCoach is a life skills training program for [...] Read more.
Background: Digital interventions are an emerging and promising avenue for addiction prevention and mental health promotion, but their reach and use are often limited, and little is known about the factors associated with youth accessibility. SmartCoach is a life skills training program for addiction prevention where adolescents are proactively invited for program participation in secondary school classes. The mobile phone-based program provides individualized coaching for a period of 4 months and addresses self-management skills, social skills, and substance use resistance skills. This study examined sociodemographic and other predictors of program participation and program use. Methods: A total of 476 adolescents in 28 secondary and upper secondary school classes in the German-speaking part of Switzerland were proactively invited for participation in the SmartCoach program. Using generalized linear mixed models (GLMMs), we examined predictors of both program participation and program use at the individual and school class levels. Results: In total, 315 (66.2%) of the present 476 adolescents gave their active consent and provided the necessary information to be included in the program. None of the individual sociodemographic characteristics significantly predicted program participation, however, the participation rate was significantly higher in upper secondary school classes (84%) than secondary school classes (59%). The mean number of interactions with the program was 15.9, i.e., participants took part in almost half of the 34 possible interactions with the SmartCoach program. None of the baseline characteristics on the level of the school class significantly predicted program use. On the level of the individual, the univariate models showed that, compared to the reference category of 14-year-old students, program use was significantly lower for students who were 16 or older. Furthermore, participants with a migration background or an origin from a non-German-speaking country showed significantly lower program use. Finally, students with a medium level of perceived stress showed higher program use compared to those with a low level of stress. Within the final multivariate model for program use, only the variable “origin from a non-German-speaking country” remained significant. Conclusions: SmartCoach is an attractive offer for young people, in which two out of three young people who are invited in the classroom to participate do so. Among the program participants, the use of the program is acceptable, with an average of almost half of the content being worked on. There is potential for improvement in terms of recruitment, especially in school classes with a lower level of education. The most important starting point for improving program use lies in taking greater account of needs and wishes of students with non-German-speaking countries of origin. Full article
(This article belongs to the Special Issue Wellbeing and Mental Health among Students and Young People)
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17 pages, 3629 KiB  
Article
Exploring the Conformational Equilibrium of Mefenamic Acid Released from Silica Aerogels via NMR Analysis
by Ilya Khodov, Valentina Sobornova, Valeriya Mulloyarova, Konstantin Belov, Alexey Dyshin, Luís Batista de Carvalho, Peter Tolstoy and Michael Kiselev
Int. J. Mol. Sci. 2023, 24(8), 6882; https://doi.org/10.3390/ijms24086882 - 7 Apr 2023
Cited by 15 | Viewed by 17672
Abstract
This study examines the influence of mefenamic acid on the physical and chemical properties of silica aerogels, as well as its effect on the sorption characteristics of the composite material. Solid state magic angle spinning nuclear magnetic resonance (MAS NMR) and high-pressure 13 [...] Read more.
This study examines the influence of mefenamic acid on the physical and chemical properties of silica aerogels, as well as its effect on the sorption characteristics of the composite material. Solid state magic angle spinning nuclear magnetic resonance (MAS NMR) and high-pressure 13C NMR kinetic studies were conducted to identify the presence of mefenamic acid and measure the kinetic rates of CO2 sorption. Additionally, a high-pressure T1–T2 relaxation-relaxation correlation spectroscopy (RRCOSY) study was conducted to estimate the relative amount of mefenamic acid in the aerogel’s pores, and a high-pressure nuclear Overhauser effect spectoscopy (NOESY) study was conducted to investigate the conformational preference of mefenamic acid released from the aerogel. The results indicate that mefenamic acid is affected by the chemical environment of the aerogel, altering the ratio of mefenamic acid conformers from 75% to 25% in its absence to 22% to 78% in the presence of aerogel. Full article
(This article belongs to the Special Issue Advances in NMR Spectroscopy for Bioactive Small Molecules)
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14 pages, 3537 KiB  
Article
Investigation of the Spatial Structure of Flufenamic Acid in Supercritical Carbon Dioxide Media via 2D NOESY
by Ilya A. Khodov, Konstantin V. Belov, Michael A. Krestyaninov, Alexey A. Dyshin and Michael G. Kiselev
Materials 2023, 16(4), 1524; https://doi.org/10.3390/ma16041524 - 11 Feb 2023
Cited by 14 | Viewed by 17205
Abstract
The search for new forms of already known drug compounds is an urgent problem of high relevance as more potent drugs with fewer side effects are needed. The trifluoromethyl group in flufenamic acid renders its chemical structure differently from other fenamates. This modification [...] Read more.
The search for new forms of already known drug compounds is an urgent problem of high relevance as more potent drugs with fewer side effects are needed. The trifluoromethyl group in flufenamic acid renders its chemical structure differently from other fenamates. This modification is responsible for a large number of conformational polymorphs. Therefore, flufenamic acid is a promising structural modification of well-known drug molecules. An effective approach in this field is micronization, employing “green” supercritical fluid technologies. This research raises some key questions to be answered on how to control polymorphic forms during the micronization of drug compounds. The results presented in this work demonstrate the ability of two-dimensional nuclear Overhauser effect spectroscopy to determine conformational preferences of small molecular weight drug compounds in solutions and fluids, which can be used to predict the polymorphic form during the micronization. Quantitative analysis was carried out to identify the conformational preferences of flufenamic acid molecules in dimethyl sulfoxide-d6 medium at 25 °C and 0.1 MPa, and in mixed solvent medium containing supercritical carbon dioxide at 45 °C and 9 MPa. The data presented allows predictions of the flufenamic acid conformational preferences of poorly soluble drug compounds to obtain new micronized forms. Full article
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18 pages, 17055 KiB  
Article
Molecular Mechanism of Conformational Crossover of Mefenamic Acid Molecules in scCO2
by Roman D. Oparin, Mikhail A. Krestyaninov, Dmitry V. Ivlev and Michael G. Kiselev
Materials 2023, 16(4), 1403; https://doi.org/10.3390/ma16041403 - 7 Feb 2023
Cited by 2 | Viewed by 1551
Abstract
In this work, we studied conformational equilibria of molecules of mefenamic acid in its diluted solution in scCO2 under isochoric heating conditions in the temperature range of 140–210 °C along the isochore corresponding to the scCO2 density of 1.1 of its [...] Read more.
In this work, we studied conformational equilibria of molecules of mefenamic acid in its diluted solution in scCO2 under isochoric heating conditions in the temperature range of 140–210 °C along the isochore corresponding to the scCO2 density of 1.1 of its critical value. This phase diagram range totally covers the region of conformational transitions of molecules of mefenamic acid in its saturated solution in scCO2. We found that in the considered phase diagram region, the equilibrium of two conformers is realized in this solution. In the temperature range of 140–180 °C, conformer I related to the first, most stable polymorph of mefenamic acid prevails. In the temperature range of 200–210 °C, conformer II, which is related to the second metastable polymorph becomes dominant. Based on the results of quantum chemical calculations and experimental IR spectroscopy data on the mefenamic acid conformer populations, we classified this temperature-induced conformational crossover as an entropy-driven phenomenon. Full article
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18 pages, 3098 KiB  
Article
Molecular Dynamics and Nuclear Magnetic Resonance Studies of Supercritical CO2 Sorption in Poly(Methyl Methacrylate)
by Valentina V. Sobornova, Konstantin V. Belov, Alexey A. Dyshin, Darya L. Gurina, Ilya A. Khodov and Michael G. Kiselev
Polymers 2022, 14(23), 5332; https://doi.org/10.3390/polym14235332 - 6 Dec 2022
Cited by 9 | Viewed by 16662
Abstract
The study of supercritical carbon dioxide sorption processes is an important and urgent task in the field of “green” chemistry and for the selection of conditions for new polymer material formation. However, at the moment, the research of these processes is very limited, [...] Read more.
The study of supercritical carbon dioxide sorption processes is an important and urgent task in the field of “green” chemistry and for the selection of conditions for new polymer material formation. However, at the moment, the research of these processes is very limited, and it is necessary to select the methodology for each polymer material separately. In this paper, the principal possibility to study the powder sorption processes using 13C nuclear magnetic resonance spectroscopy, relaxation-relaxation correlation spectroscopy and molecular dynamic modeling methods will be demonstrated based on the example of polymethylmethacrylate and supercritical carbon dioxide. It was found that in the first nanoseconds and seconds during the sorption process, most of the carbon dioxide, about 75%, is sorbed into polymethylmethacrylate, while on the clock scale the remaining 25% is sorbed. The methodology presented in this paper makes it possible to select optimal conditions for technological processes associated with the production of new polymer materials based on supercritical fluids. Full article
(This article belongs to the Special Issue Molecular Simulation and Modeling of Polymers)
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11 pages, 3384 KiB  
Article
Study of Dispersions of Carbon Nanotubes Modified by the Method of Rapid Expansion of Supercritical Suspensions
by Konstantin B. Ustinovich, Victor V. Ivanov, Yurij M. Tokunov, Alexander A. Loshkarev, Natalya I. Sapronova, Anton M. Vorobei, Olga O. Parenago and Michael G. Kiselev
Molecules 2020, 25(18), 4061; https://doi.org/10.3390/molecules25184061 - 5 Sep 2020
Cited by 11 | Viewed by 3666
Abstract
The effectiveness of carbon nanotubes (CNT) deagglomeration by rapid expansion of supercritical suspensions (RESS) in nitrogen and carbon dioxide fluids was studied in this work. Two different mechanisms of deagglomeration were proposed for these two fluids at various temperature and pressure conditions. Ultrasound [...] Read more.
The effectiveness of carbon nanotubes (CNT) deagglomeration by rapid expansion of supercritical suspensions (RESS) in nitrogen and carbon dioxide fluids was studied in this work. Two different mechanisms of deagglomeration were proposed for these two fluids at various temperature and pressure conditions. Ultrasound attenuation spectroscopy was applied as an express method of determining median diameter and aspect ratio of CNTs. At least twofold reduction of the diameter was shown for CNT bundles processed by RESS technique. Aspect ratio of processed CNTs, calculated from acoustic attenuation spectra, increased to 340. These results were in a good agreement with atomic force microscopy data. Full article
(This article belongs to the Special Issue Applications of Supercritical Carbon Dioxide)
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2 pages, 637 KiB  
Erratum
Erratum: Kiselev, I., et al. On the Temporal Stability of Analyte Recognition with an E-Nose Based on a Metal Oxide Sensor Array in Practical Applications. Sensors 2018, 18, 550
by Ilia Kiselev, Victor Sysoev, Igor Kaikov, Ilona Koronczi, Ruslan Adil Akai Tegin, Jamila Smanalieva, Martin Sommer, Coskan Ilicali and Michael Hauptmannl
Sensors 2019, 19(16), 3525; https://doi.org/10.3390/s19163525 - 12 Aug 2019
Cited by 1 | Viewed by 2741
Abstract
The authors wish to make the following corrections to this paper [...] Full article
30 pages, 18491 KiB  
Article
Long Slender Piezo-Resistive Silicon Microprobes for Fast Measurements of Roughness and Mechanical Properties inside Micro-Holes with Diameters below 100 µm
by Uwe Brand, Min Xu, Lutz Doering, Jannick Langfahl-Klabes, Heinrich Behle, Sebastian Bütefisch, Thomas Ahbe, Erwin Peiner, Stefan Völlmeke, Thomas Frank, Bodo Mickan, Ilia Kiselev, Michael Hauptmannl and Michael Drexel
Sensors 2019, 19(6), 1410; https://doi.org/10.3390/s19061410 - 22 Mar 2019
Cited by 18 | Viewed by 6300
Abstract
During the past decade, piezo-resistive cantilever type silicon microprobes for high-speed roughness measurements inside high-aspect-ratio microstructures, like injection nozzles or critical gas nozzles have been developed. This article summarizes their metrological properties for fast roughness and shape measurements including noise, damping, tip form, [...] Read more.
During the past decade, piezo-resistive cantilever type silicon microprobes for high-speed roughness measurements inside high-aspect-ratio microstructures, like injection nozzles or critical gas nozzles have been developed. This article summarizes their metrological properties for fast roughness and shape measurements including noise, damping, tip form, tip wear, and probing forces and presents the first results on the measurement of mechanical surface parameters. Due to the small mass of the cantilever microprobes, roughness measurements at very high traverse speeds up to 15 mm/s are possible. At these high scanning speeds, considerable wear of the integrated silicon tips was observed in the past. In this paper, a new tip-testing artefact with rectangular grooves of different width was used to measure this wear and to measure the tip shape, which is needed for morphological filtering of the measured profiles and, thus, for accurate form measurements. To reduce tip wear, the integrated silicon tips were replaced by low-wear spherical diamond tips of a 2 µm radius. Currently, a compact microprobe device with an integrated feed-unit is being developed for high-speed roughness measurements on manufacturing machines. First measurements on sinusoidal artefacts were carried out successfully. Moreover, the first measurements of the elastic modulus of a polymer surface applying the contact resonance measurement principle are presented, which indicates the high potential of these microprobes for simultaneous high-speed roughness and mechanical parameter measurements. Full article
(This article belongs to the Special Issue Cantilever Sensor)
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22 pages, 11745 KiB  
Article
On the Temporal Stability of Analyte Recognition with an E-Nose Based on a Metal Oxide Sensor Array in Practical Applications
by Ilia Kiselev, Victor Sysoev, Igor Kaikov, Ilona Koronczi, Ruslan Adil Akai Tegin, Jamila Smanalieva, Martin Sommer, Coskan Ilicali and Michael Hauptmannl
Sensors 2018, 18(2), 550; https://doi.org/10.3390/s18020550 - 11 Feb 2018
Cited by 43 | Viewed by 7025
Abstract
The paper deals with a functional instability of electronic nose (e-nose) units which significantly limits their real-life applications. Here we demonstrate how to approach this issue with example of an e-nose based on a metal oxide sensor array developed at the Karlsruhe Institute [...] Read more.
The paper deals with a functional instability of electronic nose (e-nose) units which significantly limits their real-life applications. Here we demonstrate how to approach this issue with example of an e-nose based on a metal oxide sensor array developed at the Karlsruhe Institute of Technology (Germany). We consider the instability of e-nose operation at different time scales ranging from minutes to many years. To test the e-nose we employ open-air and headspace sampling of analyte odors. The multivariate recognition algorithm to process the multisensor array signals is based on the linear discriminant analysis method. Accounting for the received results, we argue that the stability of device operation is mostly affected by accidental changes in the ambient air composition. To overcome instabilities, we introduce the add-training procedure which is found to successfully manage both the temporal changes of ambient and the drift of multisensor array properties, even long-term. The method can be easily implemented in practical applications of e-noses and improve prospects for device marketing. Full article
(This article belongs to the Special Issue Artificial Olfaction and Taste)
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