bluuebunny/crossref_metadata_2025 huggingface dataset:
Modified Protein-Water Interactions in CHARMM36m for Thermodynamics and Kinetics of Proteins in Dilute and Crowded Solutions
Authors: Matsubara Daiki , Kasahara Kento , Dokainish Hisham M. , Oshima Hiraku , Sugita Yuji
Published: September 2022

Proper balance between protein-protein and protein-water interactions is vital for atomistic molecular dynamics (MD) simulations of globular proteins as well as intrinsically disordered proteins (IDPs). The overestimation of protein-protein interactions tends to make IDPs more compact than those in experiments. Likewise, multiple proteins in crowded solutions are aggregated with each other too strongly. To optimize the balance, Lennard-Jones (LJ) interactions between protein and water are often increased about 10% (with a scaling parameter, λ = 1.1) from the existing force fields. Here, we explore the optimal scaling parameter of protein-water LJ interactions for CHARMM36m in conjunction with the modified TIP3P water model, by performing enhanced sampling MD simulations of several peptides in dilute solutions and conventional MD simulations of globular proteins in dilute and crowded solutions. In our simulations, 10% increase of protein-water LJ interaction for the CHARMM36m cannot maintain stability of a small helical peptide, (AAQAA)3 in a dilute solution and only a small modification of protein-water LJ interaction up to the 3% increase (λ = 1.03) is allowed. The modified protein-water interactions are applicable to other peptides and globular proteins in dilute solutions without changing thermodynamic properties from the original CHARMM36m. However, it has a great impact on the diffusive properties of proteins in crowded solutions, avoiding the formation of too sticky protein-protein interactions.
Sequential Processing Enables 17% All-Polymer Solar Cells via Non-Halogen Organic Solvent
Authors: Zhao Chaoyue , Wang Lihong , Zhang Guoping , Wang Yajie , Hu Ruiyu , Huang Hui , Qiu Mingxia , Li Shunpu , Zhang Guangye
Published: September 2022

All-polymer solar cells (All-PSCs), whose electron donor and acceptors are both polymeric materials, have attracted great research attention in the past few years. However, most all-PSC devices with top-of-the-line efficiencies are processed from chloroform. In this work, we apply the sequential processing (SqP) method to fabricate All-PSCs from an aromatic hydrocarbon solvent, toluene, and obtain efficiencies up to 17.0%. By conducting a series of characterizations on our films and devices, we demonstrate that the preparation of SqP devices using toluene can effectively reduce carrier recombination, enhance carrier mobility and promote the fill factor of the device.
Comparison of Two Bovine Commercial Xenografts in the Regeneration of Critical Cranial Defects
Authors: Valencia-Llano Carlos Humberto , López-Tenorio Diego , Saavedra Marcela , Zapata Paula A. , Grande-Tovar Carlos David
Published: September 2022

Autologous bone is the gold standard in regeneration processes. However, there is an endless search for alternative materials in bone regeneration. Xenografts can act as bone substitutes given the difficulty of obtaining bone tissue from patients and before the limitations in the availability of homologous tissue donors. Bone neoformation was studied in critical-size defects created in the parietal bone of 40 adult male Wistar rats, implanted with xenografts composed of particulate bovine hydroxyapatite (HA) and with blocks of bovine hydroxyapatite (HA) and Collagen, which introduces crystallinity to the materials. The Fourier-transform infrared spectroscopy (FTIR) analysis demonstrated the carbonate and phosphate groups of the hydroxyapatite and the amide groups of the collagen structure, while the thermal transitions for HA and HA/collagen composites established mainly dehydration endothermal processes, which increased (from 79 °C to 83 °C) for F2 due to the collagen presence. The xenograft’s X-ray powder diffraction (XRD) analysis also revealed the bovine HA crystalline structure, with a prominent peak centered at 32°. We observed macroporosity and mesoporosity in the xenografts from the morphology studies with heterogeneous distribution. The two xenografts induced neoformation in defects of critical size. Histological, histochemical, and scanning electron microscopy (SEM) analyses were performed 30, 60, and 90 days after implantation. The empty defects showed signs of neoformation lower than 30% in the three periods, while the defects implanted with the material showed partial regeneration. InterOss Collagen material temporarily induced osteon formation during the healing process. The results presented here are promising for bone regeneration, demonstrating a beneficial impact in the biomedical field.
Kinetic Study of the Maillard Reaction in Thin Film Generated by Microdroplets Deposition
Authors: Salvitti Chiara , de Petris Giulia , Troiani Anna , Managò Marta , Ricci Andreina , Pepi Federico
Published: September 2022

The Maillard reaction kinetics in the confined volume of the thin film produced by ESI microdroplet deposition was studied by mass spectrometry. The almost exclusive formation of the Amadori product from the reaction of D-xylose and D-glucose toward L-glycine and L-lysine was demonstrated. The thin film Maillard reaction occurred at a mild synthetic condition under which the same process in solution was not observed. The comparison of the thin film kinetics with that of the reaction performed in solution showed strong thin film rate acceleration factors.
The Influence of the Matrix on the Apatite-Forming Ability of Calcium Containing Polydimethylsiloxane-Based Cements for Endodontics
Authors: Taddei Paola , Di Foggia Michele , Zamparini Fausto , Prati Carlo , Gandolfi Maria Giovanna
Published: September 2022

This study aimed to characterize the chemical properties and bioactivity of an endodontic sealer (GuttaFlow Bioseal) based on polydimethylsiloxane (PDMS) and containing a calcium bioglass as a doping agent. Commercial PDMS-based cement free from calcium bioglass (GuttaFlow 2 and RoekoSeal) were characterized for comparison as well as GuttaFlow 2 doped with dicalcium phosphate dihydrate, hydroxyapatite, or a tricalcium silicate-based cement. IR and Raman analyses were performed on fresh materials as well as after aging tests in Hank’s Balanced Salt Solution (28 d, 37 °C). Under these conditions, the strengthening of the 970 cm−1 Raman band and the appearance of the IR components at 1455–1414, 1015, 868, and 600–559 cm−1 revealed the deposition of B-type carbonated apatite. The Raman I970/I638 and IR A1010/A1258 ratios (markers of apatite-forming ability) showed that bioactivity decreased along with the series: GuttaFlow Bioseal > GuttaFlow 2 > RoekoSeal. The PDMS matrix played a relevant role in bioactivity; in GuttaFlow 2, the crosslinking degree was favorable for Ca2+ adsorption/complexation and the formation of a thin calcium phosphate layer. In the less crosslinked RoekoSeal, such processes did not occur. The doped cements showed bioactivity higher than GuttaFlow 2, suggesting that the particles of the mineralizing agents are spontaneously exposed on the cement surface, although the hydrophobicity of the PDMS matrix slowed down apatite deposition. Relevant properties in the endodontic practice (i.e., setting time, radiopacity, apatite-forming ability) were related to material composition and the crosslinking degree.
Application of CO2 Supercritical Fluid to Optimize the Solubility of Oxaprozin: Development of Novel Machine Learning Predictive Models
Authors: Alshahrani Saad M. , Saqr Ahmed Al , Alfadhel Munerah M. , Alshetaili Abdullah S. , Almutairy Bjad K. , Alsubaiyel Amal M. , Almari Ali H. , Alamoudi Jawaher Abdullah , Abourehab Mohammed A. S.
Published: September 2022

Over the last years, extensive motivation has emerged towards the application of supercritical carbon dioxide (SCCO2) for particle engineering. SCCO2 has great potential for application as a green and eco-friendly technique to reach small crystalline particles with narrow particle size distribution. In this paper, an artificial intelligence (AI) method has been used as an efficient and versatile tool to predict and consequently optimize the solubility of oxaprozin in SCCO2 systems. Three learning methods, including multi-layer perceptron (MLP), Kriging or Gaussian process regression (GPR), and k-nearest neighbors (KNN) are selected to make models on the tiny dataset. The dataset includes 32 data points with two input parameters (temperature and pressure) and one output (solubility). The optimized models were tested with standard metrics. MLP, GPR, and KNN have error rates of 2.079 × 10−8, 2.173 × 10−9, and 1.372 × 10−8, respectively, using MSE metrics. Additionally, in terms of R-squared, they have scores of 0.868, 0.997, and 0.999, respectively. The optimal inputs are the same as the maximum possible values and are paired with a solubility of 1.26 × 10−3 as an output.
Photodynamic Inactivation of Microorganisms Using Semisynthetic Chlorophyll a Derivatives as Photosensitizers
Authors: Uliana Marciana Pierina , da Cruz Rodrigues Andréia , Ono Bruno Andrade , Pratavieira Sebastião , de Oliveira Kleber Thiago , Kurachi Cristina
Published: September 2022

In this study, we describe the semisynthesis of cost-effective photosensitizers (PSs) derived from chlorophyll a containing different substituents and using previously described methods from the literature. We compared their structures when used in photodynamic inactivation (PDI) against Staphylococcus aureus, Escherichia coli, and Candida albicans under different conditions. The PSs containing carboxylic acids and butyl groups were highly effective against S. aureus and C. albicans following our PDI protocol. Overall, our results indicate that these nature-inspired PSs are a promising alternative to selectively inactivate microorganisms using PDI.
Functional Characterization of an Arabidopsis Profilin Protein as a Molecular Chaperone under Heat Shock Stress
Authors: Son Hyosuk , Jung Young Jun , Park Seong-Cheol , Kim Il Ryong , Park Joung Hun , Jang Mi-Kyeong , Lee Jung Ro
Published: September 2022

Profilins (PFNs) are actin monomer-binding proteins that function as antimicrobial agents in plant phloem sap. Although the roles of Arabidopsis thaliana profilin protein isoforms (AtPFNs) in regulating actin polymerization have already been described, their biochemical and molecular functions remain to be elucidated. Interestingly, a previous study indicated that AtPFN2 with high molecular weight (HMW) complexes showed lower antifungal activity than AtPFN1 with low molecular weight (LMW). These were bacterially expressed and purified to characterize the unknown functions of AtPFNs with different structures. In this study, we found that AtPFN1 and AtPFN2 proteins have LMW and HMW structures, respectively, but only AtPFN2 has a potential function as a molecular chaperone, which has never been reported elsewhere. AtPFN2 has better protein stability than AtPFN1 due to its higher molecular weight under heat shock conditions. The function of AtPFN2 as a holdase chaperone predominated in the HMW complexes, whereas the chaperone function of AtPFN1 was not observed in the LMW forms. These results suggest that AtPFN2 plays a critical role in plant tolerance by increasing hydrophobicity due to external heat stress.
A Genotype-Independent, Simple, Effective and Efficient in Planta Agrobacterium-Mediated Genetic Transformation Protocol
Authors: Kharb Pushpa , Chaudhary Rinku , Tuteja Narendra , Kaushik Prashant
Published: September 2022

Crop improvement under changing climatic conditions is required to feed the growing global population. The development of transgenic crops is an attractive and conceivably the most effective approach for crop improvement with desired traits in varying climatic situations. Here, we describe a simple, efficient and robust in planta Agrobacterium-mediated genetic transformation method that can be used in most crops, including rice, wheat and cotton, and particularly in tissue culture recalcitrant crops, such as chickpea and pigeon pea. The protocol was successfully used for the development of transgenic chickpea and pigeon pea lines for resistance against pod borer. Transgenic lines in chickpea, pigeon pea and wheat were also developed for salt stress tolerance. These lines exhibited improved salt tolerance in terms of various physio-biochemical parameters studied. Since the protocol is rapid, as no tissue culture step is involved, it will significantly contribute to the improvement of most crops and will be of interest for plant biologists working with genetic engineering or genome editing.
Physically Transient, Flexible, and Resistive Random Access Memory Based on Silver Ions and Egg Albumen Composites
Authors: Wang Lu , Zhang Yukai , Zhang Peng , Wen Dianzhong
Published: September 2022

Organic-resistance random access memory has high application potential in the field of next-generation green nonvolatile memory. Because of their biocompatibility and environmental friendliness, natural biomaterials are suitable for the fabrication of biodegradable and physically transient resistive switching memory devices. A flexible memory device with physically transient properties was fabricated with silver ions and egg albumen composites as active layers, which exhibited characteristics of write-once-read-many-times (WORM), and the incorporation of silver ions improved the ON/OFF current ratio of the device. The device can not only complete the logical operations of “AND gate” and “OR gate”, but its active layer film can also be dissolved in deionized water, indicating that it has the characteristics of physical transients. This biocompatible memory device is a strong candidate for a memory element for the construction of transient electronic systems.
Attapulgite Nanorods Incorporated MXene Lamellar Membranes for Enhanced Decontamination of Dye Wastewater
Authors: Zhang Shiyang , Wang Zhi , Cai Mingwei , Lu Xiaochuang , Fan Tianju , Wang Ruibin , Liu Yidong , Min Yonggang
Published: September 2022

Due to its unique physical and chemical properties, MXene has recently attracted much attention as a promising candidate for wastewater treatment. However, the low water permeation flux of MXene membrane remains a challenge that has not been fully solved. In this study, attapulgite was used to increase the flux of MXene membrane through a facile one-pot method, during which the MXene nanosheets were self-assembled while being intercalated by the attapulgite nanorods to finally form the composite membranes. Under optimal conditions, an increase of water permeation flux of 97.31% could be observed, which was attributed to the broadened nano-channel upon the adequate intercalation of attapulgite nanorods. Its permeation flux and rejection rate for methylene blue (MB) were further studied for diverse applications. In contrast to bare MXene, the permeation flux increased by 61.72% with a still high rejection rate of 90.67%, owing to the size rejection. Overcoming a key technique barrier, this work successfully improved the water permeability of MXene by inserting attapulgite nanorods, heralding the exciting prospects of MXene-based lamellar membrane in dye wastewater treatment.
Unveiling the Origin of the Selectivity and the Molecular Mechanism in the [3+2] Cycloaddition Reaction of N-aryl-C-carbamoylnitrone with N-arylitaconimide
Authors: Khorief Nacereddine Abdelmalek , Chafaa Fouad
Published: September 2022

The [3+2] cycloaddition reaction of N-aryl-C-carbamoylnitrone (nitrone 1) with N-arylitaconimide (ethylene 2) was computationally studied using the B3LYP/6-31G(d) level of theory. An analysis of the different energetic profiles and the transition states’ optimized structures clearly indicated that this 32CA occurred through a non-polar, asynchronous, one-step mechanism, favoring the formation of the ortho–endo cycloadduct, as observed experimentally. The analysis of the reactivity indices derived from the conceptual DFT explains well the low polarity of this 32CA reaction. Parr functions and a dual reactivity descriptors analysis correctly explained the regioselectivity ortho of this 32CA reaction. Solvent effects did not modify the obtained selectivity but it increased the activation energies and decreased the exothermic character of this 32CA reaction. A thermodynamic parameters analysis indicated that this 32CA wascharacterized by an ortho regioselectivity and endostereoselectivity and exothermic and exergonic characters.
Bulk Viscosity of Relativistic npeμ Matter in Neutron-Star Mergers
Authors: Alford Mark , Harutyunyan Arus , Sedrakian Armen
Published: September 2022

We discuss the bulk viscosity of hot and dense npeμ matter arising from weak-interaction direct Urca processes. We consider two regimes of interest: (a) the neutrino-transparent regime with T≤Ttr (Ttr≃5÷10 MeV is the neutrino-trapping temperature); and (b) the neutrino-trapped regime with T≥Ttr. Nuclear matter is modeled in relativistic density functional approach with density-dependent parametrization DDME2. The maximum of the bulk viscosity is achieved at temperatures T≃5÷6 MeV in the neutrino-transparent regime, then it drops rapidly at higher temperatures where neutrino-trapping occurs. As an astrophysical application, we estimate the damping timescales of density oscillations by the bulk viscosity in neutron star mergers and find that, e.g., at the oscillation frequency f=10 kHz, the damping will be very efficient at temperatures 4≤T≤7 MeV where the bulk viscosity might affect the evolution of the post-merger object.
MicroRNA-122 Regulation of HCV Infections: Insights from Studies of miR-122-Independent Replication
Authors: Panigrahi Mamata , Palmer Michael A. , Wilson Joyce A.
Published: September 2022

Despite the advancement in antiviral therapy, Hepatitis C remains a global health challenge and one of the leading causes of hepatitis related deaths worldwide. Hepatitis C virus, the causative agent, is a positive strand RNA virus that requires a liver specific microRNA called miR-122 for its replication. Unconventional to the canonical role of miRNAs in translation suppression by binding to 3′Untranslated Region (UTR) of messenger RNAs, miR-122 binds to two sites on the 5′UTR of viral genome and promotes viral propagation. In this review, we describe the unique relationship between the liver specific microRNA and HCV, the current knowledge on the mechanisms by which the virus uses miR-122 to promote the virus life cycle, and how miR-122 impacts viral tropism and pathogenesis. We will also discuss the use of anti-miR-122 therapy and its impact on viral evolution of miR-122-independent replication. This review further provides insight into how viruses manipulate host factors at the initial stage of infection to establish a successful infection.
Association between Mutations in Papain-like Protease (PLpro) of SARS-CoV-2 with COVID-19 Clinical Outcomes
Authors: Tan Jinlin , Wu Zhilong , Hu Peipei , Gan Lin , Wang Ying , Zhang Dingmei
Published: September 2022

Papain-like protease (PLpro) is important for the replication and transcription of severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2). This study aimed to reveal the PLpro mutations associated with the clinical outcomes of patients. Due to the importance of the S protein in the pathogenicity of SARS-CoV-2, the mutation of the S protein was also analyzed in this study. After downloading the data from the Global Initiative on Sharing Avian Influenza Data (GISAID) database, samples were divided into two groups on the basis of patient status, namely, recovered and dead groups. This study performed a univariate analysis and further explored the association of mutations with patient outcomes through multivariate logistic regression analysis. A total of 138,492 samples were used for analysis. The patients had a mean age of 43.66 ± 21.56 years, and 51.3% of them were female. Multivariate logistic regression results showed that, compared with men, women had a lower risk of dying from coronavirus disease 2019 (COVID-19) (OR = 0.687, 95%CI: 0.638–0.740). Compared with patients aged 17 years and younger, patients aged 18–64 years (OR = 2.864, 95%CI: 1.982–4.139) and patients over 65 years old (OR = 19.135, 95%CI: 13.280–27.572) had a higher risk of death after infection. Compared with the wild type, P78L (OR = 5.185, 95%CI: 2.763–9.730) and K233Q (OR = 5.154, 95%CI: 1.442–18.416) in PLpro were associated with an increased risk of death. A synergistic interaction existed between age and mutations A146D and P78L. The results of the multivariate logistic regression analysis of the data on vaccinated patients demonstrated that, compared with the wild type, the P78L (OR = 3.376, 95%CI: 2.040–5.585) mutation was associated with an increased risk of death. In conclusion, compared with the wild-type PLpro protein, the P78L and K233Q mutations may increase the risk of death in infected individuals. In addition, a synergistic effect existed between age and P78L and K233Q that increased the risk of death in older patients.
Differentially Represented Proteins in Response to Infection with Mycobacterium tuberculosis Identified by Quantitative Serum Proteomics in Asian Elephants
Authors: Villar Margarita , Rajbhandari Rajesh Man , Artigas-Jerónimo Sara , Contreras Marinela , Sadaula Amir , Karmacharya Dibesh , Alves Paulo Célio , Gortázar Christian , de la Fuente José
Published: September 2022

Tuberculosis is a major global concern. Tuberculosis in wildlife is a risk for zoonotic transmission and becoming one of the challenges for conservation globally. In elephants, the number of cases is likely rising. The aim of this study was to identify proteins related to tuberculosis infection in elephants, which could then be used for the development of diagnostic tools and/or vaccines. A serum proteomics approach was used to characterize differentially represented proteins in response to Mycobacterium tuberculosis in Asian elephants (Elaphas maximus). Blood samples were collected from eight elephants, four of which were antibody positive for tuberculosis and four were antibody negative. Proteomics analysis identified 26 significantly dysregulated proteins in response to tuberculosis. Of these, 10 (38%) were identified as immunoglobulin and 16 (62%) as non-immunoglobulin proteins. The results provided new information on the antibody response to mycobacterial infection and biomarkers associated with tuberculosis and protective response to mycobacteria in Asian elephants. Protective mechanisms included defense against infection (Alpha-1-B glycoprotein A1BG, Serpin family A member 1 SERPINA1, Transthyretin TTR), neuroprotection (TTR), and reduced risks of inflammation, infections, and cancer (SERPINA1, Keratin 10 KRT10). Using a translational biotechnology approach, the results provided information for the identification of candidate diagnostic, prognostic, and protective antigens for monitoring and control of tuberculosis in Asian elephants.
Effects of a Novel, Intelligent, pH-Responsive Resin Adhesive on Cariogenic Biofilms In Vitro
Authors: Shi Yangyang , Liang Jingou , Zhou Xuedong , Ren Biao , Wang Haohao , Han Qi , Li Hao , Cheng Lei
Published: September 2022

Background: Secondary caries often result in a high failure rate of resin composite restoration. Herein, we studied the dodecylmethylaminoethyl methacrylate–modified resin adhesive (DMAEM@RA) to investigate its pH-responsive antimicrobial effect on Streptococcus mutans and Candida albicans dual-species biofilms and on secondary caries. Methods: Firstly, the pH-responsive antimicrobial experiments including colony-forming units, scanning electron microscopy and exopoly-saccharide staining were measured. Secondly, lactic acid measurement and transverse microradiography analysis were performed to determine the preventive effect of DMAEM@RA on secondary caries. Lastly, quantitative real-time PCR was applied to investigate the antimicrobial effect of DMAEM@RA on cariogenic virulence genes. Results: DMAEM@RA significantly inhibited the growth, EPS, and acid production of Streptococcus mutans and Candida albicans dual-species biofilms under acidic environments (p < 0.05). Moreover, at pH 5 and 5.5, DMAEM@RA remarkably decreased the mineral loss and lesion depth of tooth hard tissue (p < 0.05) and down-regulated the expression of cariogenic genes, virulence-associated genes, and pH-regulated genes of dual-species biofilms (p < 0.05). Conclusions: DMAEM@RA played an antibiofilm role on Streptococcus mutans and Candida albicans dual-species biofilms, prevented the demineralization process, and attenuated cariogenic virulence in a pH-dependent manner.
Epidemiological and Phylogeographic Study of Equid Herpesviruses in Tunisia
Authors: Badr Chaima , Souiai Oussama , Arbi Marwa , El Behi Imen , Essaied Mohamed S. , Khosrof Ines , Benkahla Alia , Chabchoub Ahmed , Ghram Abdeljelil
Published: September 2022

Equid herpesvirus (EHV) is a contagious viral disease affecting horses, causing illness characterized by respiratory symptoms, abortion and neurological disorders. It is common worldwide and causes severe economic losses to the equine industry. The present study was aimed at investigating the incidence of EHVs, the genetic characterization of Tunisian isolates and a spatiotemporal study, using 298 collected samples from diseased and clinically healthy horses. The global incidence of EHV infection was found to be about 71.81%. EHV2 and EHV5 were detected in 146 (48.99%) and 159 (53.35%) sampled horses, respectively. EHV1 was detected in 11 samples (3.69%); EHV4 was not detected. Co-infections with EHV1-EHV2, EHV1-EHV5 and EHV2-EHV5 were observed in 0.33%, 1.34% and 31.54% of tested horses, respectively. Phylogenetic analyses showed that gB of EHV2 and EHV5 displays high genetic diversity with a nucleotide sequence identity ranging from 88 to 100% for EHV2 and 97.5 to 100% for EHV5. Phylogeography suggested Iceland and USA as the most likely countries of origin of the Tunisian EHV2 and EHV5 isolates. These viruses detected in Tunisia seemed to be introduced in the 2000s. This first epidemiological and phylogeographic study is important for better knowledge of the evolution of equid herpesvirus infections in Tunisia.
Peptide Shuttles for Blood–Brain Barrier Drug Delivery
Authors: Sánchez-Navarro Macarena , Giralt Ernest
Published: September 2022

The blood–brain barrier (BBB) limits the delivery of therapeutics to the brain but also represents the main gate for nutrient entrance. Targeting the natural transport mechanisms of the BBB offers an attractive route for brain drug delivery. Peptide shuttles are able to use these mechanisms to increase the transport of compounds that cannot cross the BBB unaided. As peptides are a group of biomolecules with unique physicochemical and structural properties, the field of peptide shuttles has substantially evolved in the last few years. In this review, we analyze the main classifications of BBB–peptide shuttles and the leading sources used to discover them.
Exploring the Experiences of Pharmacy Students and Their Transition to Online Learning during COVID-19
Authors: Morling Aleisha C , Wang Shou-Yu , Spark M. Joy
Published: September 2022

Due to the heavy focus on development of communication skills, compounding laboratories and many practical workshops, undertaking a registerable pharmacist qualification in an online format is typically not an option for students. COVID-19 presented on-campus pharmacy students with the opportunity to experience online learning. The aim of this study was to explore the experiences of on-campus pharmacy students who were required to move their studies to online learning during the COVID-19 pandemic. An interpretive phenomenological methodology was adopted, and semi-structured interviews were conducted with pharmacy students who were originally enrolled in on-campus learning and had to transition to online learning. Data were analyzed using a hermeneutic phenomenological approach whereby themes were identified to aid in the development of the phenomena guided by ‘lived experience’. Seven interviews were conducted with pharmacy students. Four emergent themes resulted from the interviews: (1) life as an on-campus pharmacy student, (2) preconceived ideas of online learning, (3) learning differences as an online pharmacy student and (4) the future of online pharmacy programs. Students were initially hesitant to transition to online learning due to preconceived ideas and expectations that may have tainted their overall experience. Pharmacy students preferred face-to-face learning due to their sociable personality and heavy dependence on peer and teacher support. All participants reported that they preferred face-to-face learning and acknowledged that fully online programs were not suited to their learning style or to the discipline of pharmacy. After their experience of online learning, participants believed that there was a place for online learning components in pharmacy courses. Lectures and some discussion workshops could be delivered online, but some aspects, such as compounding; dispensing; counselling; and demonstration of medication delivery devices, such as asthma inhalers and injectable diabetes products, should be delivered on campus.
Introduction to Special Issue Time Travel
Authors: Richmond Alasdair
Published: September 2022

The philosophy of time travel has an illustrious pedigree, having seen ground-breaking physical and philosophical treatments in the late 1940s and early 1950s from Kurt Gödel [...]
Performance Analysis of a Multi-Hop Parallel Hybrid FSO/RF System over a Gamma–Gamma Turbulence Channel with Pointing Errors and a Nakagami-m Fading Channel
Authors: Wu Yan , Chen Jing , Guo Jianzhong , Li Gang , Kong Dejin
Published: September 2022

Due to the influence of the atmospheric environment and pointing errors, the performance of free space optical communication is greatly limited. In this paper, we propose a parallel multi-hop hybrid free space optical (FSO)/radio frequency (RF) system to improve the system performance. The FSO sub-link and RF sub-link are modeled by Gamma–Gamma turbulence with pointing errors and Nakagami-m distributions, respectively. Based on the selective combination scheme, the probability density function (PDF) and cumulative distribution function (CDF) of the output signal-to-noise ratio (SNR) of the hybrid FSO/RF one-hop or direct link are obtained. Then, the PDF and CDF of the output SNR of the parallel multi-hop hybrid system are derived with the decoded forward (DF) protocol considered. Finally, the expressions of the average bit error rate (ABER) and outage probability are derived for the parallel multi-hop hybrid system, the hybrid FSO/RF direct link, and the FSO-only direct link. The results show that the parallel multi-hop hybrid system can effectively mitigate the negative impact of atmospheric turbulence and pointing errors and can significantly improve the system performance.
Deep Learning-Based Robust Visible Light Positioning for High-Speed Vehicles
Authors: Li Danjie , Wei Zhanhang , Yang Ganhong , Yang Yi , Li Jingwen , Yu Mingyang , Lin Puxi , Lin Jiajun , Chen Shuyu , Lu Mingli , Chen Zhe , Jiang Zoe Lin , Fang Junbin
Published: September 2022

Robustness is a key factor for real-time positioning and navigation, especially for high-speed vehicles. While visible light positioning (VLP) based on LED illumination and image sensors is widely studied, most of the VLP systems still suffer from the high positioning latency and the image blurs caused by high-speed movements. In this paper, a robust VLP system for high-speed vehicles is proposed based on a deep learning and data-driven approach. The proposed system can significantly increase the success rate of decoding VLP-LED user identifications (UID) from blurred images and reduce the computational latency for detecting and extracting VLP-LED stripe image regions from captured images. Experimental results show that the success rate of UID decoding using the proposed BN-CNN model could be higher than 98% when that of the traditional Zbar-based decoder falls to 0, while the computational time for positioning is decreased to 9.19 ms and the supported moving speed of our scheme can achieve 38.5 km/h. Therefore, the proposed VLP system can enhance the robustness against high-speed movement and guarantee the real-time response for positioning and navigation for high-speed vehicles.
Improving the Holographic Recording Characteristics of a Water-Resistant Photosensitive Sol–Gel for Use in Volume Holographic Optical Elements
Authors: Rogers Brian , Mikulchyk Tatsiana , Oubaha Mohamed , Cody Dervil , Martin Suzanne , Naydenova Izabela
Published: September 2022

Continual improvements to holographic recording materials make the development of volume holographic optical elements increasingly more attainable for applications where highly efficient, lightweight diffractive optical elements can replace conventional optics. A fast-curing, water resistant photosensitive sol–gel capable of volume holographic recording has recently drawn attention for its extreme environmental and physical robustness, in particular its water/moisture and scratch resistance. However, to date, the refractive index modulation has been limited. While water-resistant properties are invaluable in the face of the weathering which many practical systems for outdoor applications will endure, high refractive index modulation is also important in order to facilitate high diffraction efficiency holograms recorded in relatively thin layers. Lower grating thickness ensures a large angular and wavelength range of operation-properties that are critical for many applications of holographic optical elements such as solar light harvesting, optical displays and illumination management. For any application where low-cost mass production is envisaged, sensitivity/writing speed is also a crucial factor. In this research, we studied the recording properties of these water-resistant photosensitive sol–gel layers at two different recording wavelengths (532 and 476 nm) and investigated methods for improving these properties. We report more than two-fold improvement of the refractive index modulation from 1.4×10−3 to 3.3×10−3 in layers of thickness ranging from 40–100 μm and more than an order of magnitude increase in photosensitivity/recording speed through better matching between recording wavelength and layer absorption, chemical alterations and thermal post-processing techniques.
Facile Preparation of Flexible Lateral 2D MoS2 Nanosheets for Photoelectrochemical Hydrogen Generation and Optoelectronic Applications
Authors: Abdelazeez Ahmed Adel A. , Ben Gouider Trabelsi Amira , Alkallas Fatemah. H. , Elaissi Samira , Rabia Mohamed
Published: September 2022

Two-dimensional (2D) materials have attracted significant attention with their high optical response due to their interesting and unique fundamental phenomena. A lateral 2D MoS2 nanosheets was prepared via a facile one-step electrophoretic deposition method on polyethylene terephthalate (PET)/ITO. These nanosheets have been used as photoelectrode materials for photoelectrochemical (PEC) hydrogen generation and optoelectronics. The chemical structure and morphology were confirmed using X-ray diffraction (XRD), energy-dispersive X-ray spectroscopy (EDX), Raman, scanning electron microscope (SEM), and transmission electron microscopy (TEM). The optical absorbance of the 2D MoS2 nanosheets extended to the UV, Vis, and near-IR regions with a bandgap value of 1.59 eV. The testing of the prepared photoelectrode material, PET/ITO/MoS2, was carried out through a three-electrode system, in which the current density (Jph) value represents the rate of H2 gas evaluated. The Jph enhanced under light illumination compared to the dark conditions with values of 0.4 to 0.98 mA·cm−2, respectively. The produced photocurrent at V = 0 V was 0.44 mA·cm−2. This confirms the great abilities of the PET/ITO/MoS2 photoelectrode in light detection and hydrogen generation with high photoresponsivity values. Soon, our team will work on the development of a prototype of this three-electrode cell to convert the water directly into H2 fuel gas that could be applied in houses and factories, or even in advanced technology such as spacecraft and airplane F-35s by providing H2 gas as a renewable energy source.
Camouflage Target Recognition Based on Dimension Reduction Analysis of Hyperspectral Image Regions
Authors: Zhao Jiale , Zhou Bing , Wang Guanglong , Liu Jie , Ying Jiaju
Published: September 2022

Hyperspectral reconnaissance technology can realize three-dimensional reconnaissance by using target space and spectral information, which effectively improves the efficiency of battlefield reconnaissance. However, in order to obscure what is true and what is false to confuse the enemy, camouflage technology is also developing. Hiding the target in the background environment and setting false targets have become common camouflage procedures on the battlefield. The camouflaged target has very similar spatial and spectral characteristics to the real target, so the method of identifying the camouflaged target according to the similarity threshold of the original spectral data is no longer reliable. In order to solve the problem of high spectral similarity and low discrimination between a camouflaged target and a real target in a hyperspectral image, a joint processing method of spatial spectrum information is adopted in this paper. Firstly, the hyperspectral image is preprocessed, and then the target area to be measured is determined. Finally, the dimensions of the determined sensitive small area are reduced. Experiments show that this processing method can effectively reduce the spectral similarity of true and false targets, increase the spectral difference of true and false targets and improve the ability to identify true and false targets based on hyperspectral images.
Recent Progress on the Sum over Paths Approach in Quantum Mechanics Education
Authors: Malgieri Massimiliano , Onorato Pasquale
Published: September 2022

In this paper, we present an overview of recent developments in the Feynman sum over paths approach for teaching introductory quantum mechanics to high school students and university undergraduates. A turning point in recent research is identified in the clarification of the distinction between the time-dependent and time-independent approaches, and it is shown how the adoption of the latter has allowed new educational reconstructions to proceed much farther beyond what had previously been achieved. It is argued that sum over paths has now reached full maturity as an educational reconstruction of quantum physics and offers several advantages with respect to other approaches in terms of leading students to develop consistent mental models of quantum phenomena, achieving better conceptual understanding and a higher degree of longitudinal integration of knowledge.
Investigation of Possible Effects of Wearing Exoskeletons during Welding on Heart Rate
Authors: Schalk Marco , Schalk Ines , Bauernhansl Thomas , Siegert Jörg , Schneider Urs
Published: September 2022

This study aims to investigate the possible effects of wearing exoskeletons during welding on heart rate. Additionally, the validity of a measuring instrument for determining acute heart rate is to be assessed. N = 15 young healthy subjects with welding experience took part in the study. The study design defines a one-hour workflow that abstracts welding and grinding tasks. The sequence is based on the internationally recognized standard DIN EN ISO 9606-1 and reproduces authentic work sequences in constrained body positions. Each subject completed the workflow once with and once without an exoskeleton. Recorded measures were the heart rates measured by a wrist-worn smartwatch and by Impedance Cardiography (ICG). The average heart rate shows no statistically significant differences in the measurement series with and without exoskeletons. The temporal variation of the heart rate shows a statistically significant influence of wearing exoskeletons and provides a moderate to strong effect, corresponding to a Cohens d of d = 0.78. Only 28.57% of all data series obtained with a smartwatch were equivalent to ICG-data after analysis with t-test, Pearson’s correlation, and orthogonal regression. Using averaged heart rates to assess exoskeleton effects is not a suitable measure. A trend analysis using linear regression shows moderate to strong statistically significant effects in the time course of heart rates and provides an approach to evaluate exoskeleton-induced effects.
The Effect of Ginger and Its Sub-Components on Pain
Authors: Kim Suyong , Cheon Chunhoo , Kim Bonglee , Kim Woojin
Published: September 2022

Zingiber officinale Roscoe (ginger) has long been used as an herbal medicine to treat various diseases, and its main sub-components, [6]-gingerol and [6]-shogaol, were also reported to have anti-inflammatory, anti-oxidant, and anti-tumor effects. However, their effects on various types of pain and their underlying mechanisms of action have not been clearly analyzed and understood yet. Thus, in this review, by analyzing 16 studies that used Z. officinale, [6]-gingerol, and [6]-shogaol on mechanical, spontaneous and thermal pain, their effects and mechanisms of action have been analyzed. Pain was induced by either nerve injury or chemical injections in rodents. Nine studies analyzed the analgesic effect of Z. officinale, and four and three studies focused on [6]-gingerol and [6]-shogaol, respectively. Seven papers have demonstrated the underlying mechanism of action of their analgesic effects. Studies have focused on the spinal cord and one on the dorsal root ganglion (DRG) neurons. Involvement and change in the function of serotonergic receptors (5-HT1A, B, D, and 5A), transient receptor potential vanilloid 1 (TRPV1), N-methyl-D-aspartate (NMDA) receptors, phosphorylated extracellular signal-regulated kinase 1/2 (pERK1/2), histone deacetylase 1 (HDAC1), voltage-gated sodium channel 1.8 (Nav1.8), substance P (SP), and sciatic nerve’s morphology have been observed.
WAKL8 Regulates Arabidopsis Stem Secondary Wall Development
Authors: Ma Yingxuan , Stafford Luke , Ratcliffe Julian , Bacic Antony , Johnson Kim L.
Published: September 2022

Wall-associated kinases/kinase-likes (WAKs/WAKLs) are plant cell surface sensors. A variety of studies have revealed the important functions of WAKs/WAKLs in regulating cell expansion and defense in cells with primary cell walls. Less is known about their roles during the development of the secondary cell walls (SCWs) that are present in xylem vessel (XV) and interfascicular fiber (IF) cells. In this study, we used RNA-seq data to screen Arabidopsis thaliana WAKs/WAKLs members that may be involved in SCW development and identified WAKL8 as a candidate. We obtained T-DNA insertion mutants wakl8-1 (inserted at the promoter region) and wakl8-2 (inserted at the first exon) and compared the phenotypes to wild-type (WT) plants. Decreased WAKL8 transcript levels in stems were found in the wakl8-2 mutant plants, and the phenotypes observed included reduced stem length and thinner walls in XV and IFs compared with those in the WT plants. Cell wall analysis showed no significant changes in the crystalline cellulose or lignin content in mutant stems compared with those in the WT. We found that WAKL8 had alternative spliced versions predicted to have only extracellular regions, which may interfere with the function of the full-length version of WAKL8. Our results suggest WAKL8 can regulate SCW thickening in Arabidopsis stems.
The Influence of Facebook Advertising on Increasing Sales of Micro, Small, and Medium Enterprise Products in Bandung
Authors:   Departemen Sistem Informasi, Universitas Komputer Indonesia, Indonesia, Rezma A , Elsa R , Zahrotun A ,   Departemen Ilmu Komunikasi, Universitas Komputer Indonesia, Indonesia
Published: September 2022

Increasing social media involvement in MSME business sales is now growing, starting with the number of sales made through social media networks or the internet. Behind the development of sales from social media, there is a platform that provides offers to advertise or promote products on the platform. Facebook Advertising (Facebook Ads) evolved to help sellers or online business sellers promote sales. The purpose of this study was to determine how the influence of Facebook advertising on the increase in sales of Micro, Small and Medium Enterprises (MSME) in the city of Bandung. In this study, we use quantitative research methods with descriptive studies to several respondents, especially those in the city of Bandung in order to strengthen the data that will be needed. The results of this study indicate that using Facebook Ads to increase sales of a product is sufficient to influence product sales, then it is comparable to the aims and objectives of the study. However, with the increasing number of competitors using Facebook Ads as a promotional medium, of course, some improvements are needed in the manufacture of advertising products so that the audience can be interested when they see the products to be marketed. Of course, in this case it proves that the influence of Facebook Ads as a promotional medium can affect sales increases so that it can make it easier for other businessmen to promote their products.
La involuntariedad de los actos según Francisco Suárez
Authors: Sánchez-López José Carlos
Published: September 2022

El objetivo de este artículo es definir la concepción del acto involuntario de Francisco Suárez y mostrarla como un medio que permite comprender y profundizar en su teoría de la acción humana. En esta cuestión, el Doctor Eximio parte de presupuestos elaborados por Tomás de Aquino que amplía y adapta siguiendo sus propias tesis metafísicas y teológicas sobre la relación entre Dios y las creaturas. Mostraremos cómo Suárez vincula el verdadero involuntario con el simpliciter, lo forzado, necesario e indeseado, dejando al secundum quid como un acto mixto en el que la libertad y la voluntad, pese a las injerencias externas, no quedan anuladas. Por último, subrayaremos las consecuencias de la definición suareciana de lo involuntario sobre la noción de libertad, haciendo patente que tanto una como otra serían imposibles fuera del marco teórico que él sustenta, caracterizado por la eficiencia humana (y su dependencia de la divinidad) y no por la premoción física.
The Entrepreneurial Perspective in Impact Investing Research: A Research Agenda
Authors: Eckerle Christin , Manthey Sarah , Terzidis Orestis
Published: September 2022

The Covid-19 pandemic, climate crises, and regulatory changes are only a few reasons for the growing public alertness regarding environmental and social problems. This has caused a shift in the mindset of companies and investors in terms of sustainability and the long-term impact of innovation. Thus, sustainable investments, particularly impact investments, have continued to grow in importance and momentum to shift the focus on rebuilding the economy more sustainable and future-oriented. The current state of research in this field indicates that most academic contributions are mainly about theoretical considerations and deal with various areas. There is no aggregated state of the art in academia with a focus point on impact investment for entrepreneurship. Yet, entrepreneurs are seen as key actors to drive sustainable innovation. Compared to the current growing impact investment practices and the necessity of a strategy to get financing, the topic is still relatively unexplored scientifically. In this research, a systematic literature review is conducted to further review, evaluate, and analyze the current research agenda on impact investment and show how it relates to entrepreneurship research. In particular, impact investment-related decision criteria, as well as challenges associated with this, will be presented. This contributes to the nascent literature on impact investing by documenting how impact investors stand in relation to entrepreneurial ventures and what measurement frameworks and models are already scientifically analyzed, which has practical implications for both impact investors and entrepreneurs.