bluuebunny/crossref_metadata_2025_split huggingface dataset:
Role of Cation Size on Order-Disorder Phase Transition and Cation Hopping Mechanism based on LiCB11H12
Authors: Sau Kartik , Takagi Shigeyuki , Ikeshoji Tamio , Kisu Kazuaki , Sato Ryuhei , Orimo Shin-ichi 
Published: July 2022

Abstract
Complex hydrides are of great interest for being potential candidates for the solid electrolyte of all-solid-state batteries owing to their exceptionally high ionic conductivity at a high-temperature phase. Hereafter, we study a model system (LiCB11H12) using molecular dynamics (MD) simulations based on a reported force field to investigate the role of cation size in the order-disorder phase-transition temperature (Ttran) and cationic diffusion. The MD results indicate that the lowering of Ttran is due to the high cell volume (by introducing a large-size cation) that eases the anionic rotation. The results are further confirmed by performing a few additional MD simulations by keeping fixed cation size while varying cell volumes. In addition, we obtain comparative insights into cationic density distribution, the bottlenecks of the cationic path, and its hopping mechanism when increasing cationic sizes. These findings are of fundamental importance for guiding a lower transition temperature and higher cationic diffusion for practical applications.
Electrical resistivity tomography applied for monitoring backwash efficiency in drinking water filters
Authors: Lund Majbritt Deichgræber , Bording Thue , Andersen Theis Raaschou 
Published: July 2022

Abstract
Sustainable production of drinking water requires safe and efficient production, operation, and maintenance of the entire production line. Rapid gravity granular filters in water production require periodic backwash to ensure water quantity and quality. Therefore, an efficient backwash strategy plays a key role in ensuring a sustainable operation of the filters. In this study, a real-time monitoring method based on electrical resistivity tomography has been developed and tested at full scale for a period of six months in a rapid gravity granular filter during drinking water production. It provides proof of concept for a developed equipment and monitoring strategy within the given production environment. The time series of collected data, with different depth sensitivities of the upper 40 cm filter bed, demonstrates the temporal and spatial resolution capability of the method. Results show temporal development related to dynamic operation and backwash which in this study is combined with snapshot diagnostic tools and operational parameters to increase the spatial understanding of the active processes within the filter. These results suggest electrical resistivity tomography to be a suitable method for monitoring backwash efficiency.
L-Proline: A Versatile Organo-Catalyst in Organic Chemistry
Authors: Thorat Bapu R. , Mali Suraj N. , Wavhal Swati S. , Bhagat Devidas S. , Borade Ravikumar M. , Chapolikar A. , Gandhi Ajaykumar , Shinde Pawan 
Published: July 2022

Background:
L-proline is a natural amino acid having secondary amine functionality
and acts as a bifunctional catalyst (organo-catalyst). The amino-functional group acts as Lewis
base type while carboxylic acids act as Brønsted acid type catalysts. It catalyzed different asymmetric
syntheses, including known reactions such as Aldol condensation, Mannich reaction, Michael
Addition, Knoevenagel condensation, Hantzsch synthesis, OXA-Michael Henry tandem,
Ullmann reactions, Wieland-Miescher ketone synthesis, Robinson annulation, Biginelli reaction, α-
amination. It is also an essential catalyst for synthesizing heterocyclic skeletons such as coumarin,
spiro-oxindoles, imidazoles, benzimidazoles, quinoxalines, podophyllotoxin, benzothiazoles, isoxazolidines,
phenothiazines, aziridine, indole, 1,5-benzodiazepines, pyridine, and quinazolines.

Objective:
In this review, we had the objective to critically summarize the use of proline and proline
derivatives as catalysts of multicomponent reactions performed in various media and leading
to synthetically and biologically relevant heterocycles, a very important class of compounds that
constitutes over 60% of drugs and agrochemicals.

Methods:
All scholarly articles for L-Proline catalyzed reactions were retrieved from ScienceDirect,
Google Scholar , PubMed, etc.

Results and Conclusion:
Given the importance of L-Proline based reactions, it has been observed
to have tremendous applications in organic chemistry. It can also act as a 'Green catalyst'.
Perspectives on Genetic Medicine for Cystic Fibrosis
Authors: Smirnikhina Svetlana A. 
Published: July 2022

Abstract:
Like any inherited protein deficiency disease, cystic fibrosis (CF) is a good candidate for
gene replacement therapy. Despite the tremendous efforts of scientists worldwide invested in developing
this approach, it did not lead to the expected results for various reasons discussed in this review. At
the same time, the emergence of new methods of genome editing, as well as their latest modifications,
makes it possible to bypass some of the problems of “classical” CF gene therapy. The review examines
potential therapeutic agents for CF gene therapy, methods and routes of delivery, as well as discusses
the problem of target cells for defect correction. Based on the results of these studies, editing
genetic defects in the basal cells of the lungs and their counterparts in other organs will make it possible
to create a drug for treating CF with a single administration.
Role of Glycine and Glycine Receptors in Vascular Endothelium: A New
Perspective for the Management of the Post-Ischemic Injury
Authors: Valdés-Jorquera Ricardo , Oviedo-Castro Leticia , Oliva Carolina A. , Mariqueo Trinidad A. 
Published: July 2022

Abstract:
Glycine Receptors (GlyRs) are cell-surface transmembrane proteins that belong to the Cys-loop ligand-gated ion channels superfamily (Cys-loop LGICs). Functional glycine receptors are conformed only by α-subunits (homomeric channels) or by α- and β-subunits (heteromeric channels). The role of glycine as a cytoprotective is widely studied. New information about glycine modulation of vascular endothelial cells (ECs) function emerged last year. Glycine and its receptors are recognized to play a role as neurovascular protectors by a mechanism that involves α2GlyRs. Interestingly, the expression of α2GlyRs reduces after stroke injury. However, glycine reverses the inhibition of α2GlyRs by a mechanism involving the VEGF/pSTAT3 signaling. On the other hand, consistent evidence has demonstrated that ECs participate actively in the innate and adaptive immunological response. We recently reported that GlyRs are modulated by interleukin-1β, suggesting new perspectives to explain the immune modulation of vascular function in pathological conditions such as cerebrovascular stroke. In this work, we distinguish the role of glycine and the allosteric modulation of glycine receptors as a new therapeutic target to confront post-ischemic injury.
Effect and Mechanism of Resveratrol on Neurovascular Units in Rats with
Acute Cerebral Ischemia
Authors: Zhang Jin-Xia , Zhang Zhi-Yong , Li Shi-Ying , Liu Bin 
Published: July 2022

Abstract:
The current study aimed to investigate the protective effect of resveratrol (RSV) on neurovascular
units (NVUs) in rats induced by acute cerebral ischemia. RSV could reduce the damage to I/R rats,
and the optimal concentration was 40 mg/kg/d. RSV may improve the permeability of the BBB and the
destruction of its ultrastructure by upregulating ZO-1, claudin-5, and occludin to reduce the degree of
brain edema after IR. Many structures in the NVUs were also damaged after I/R. RSV was found to have
a protective effect on NeuN, GFAP, and LN in the NVUs. With the extension of RSV administration
time, the protective effect became more significant. This protective effect may be related to the upregulation
of NeuN and LN and the inhibition of the expression of GFAP. RSV could reduce neuronal apoptosis
by upregulating XIAP and downregulating Smac and caspase-9. The inhibition of RSV on the increase in
glial cells may be related to the inhibition of connexin 43 protein expression. RSV could inhibit the content
of inflammatory factors IL-1β, IL-6, and TNF-α in the brain tissue of IR rats. RSV has a protective
effect on the NVUs-induced injury, which may be related to the regulation of apoptosis and inflammatory
signal pathway.
Network Pharmacology-Based Prediction of Active Ingredients and Mechanisms
of Zanthoxyli Bungeanum Against Lung Carcinoma
Authors: Yang Qian , Shi Xiao-peng , Ma Shanbo , Chen Yuhan , Wang Jin , Li Long , Miao Shan 
Published: July 2022

Background:
Zanthoxyli Bungeanum (ZB) has been reported to have an effect on lung
carcinoma (LC). However, the defined pharmacological mechanism of ZB on LC has not been expounded
completely because of the complicated ingredients.

Objective:
The aim of this work was to explore the active ingredients and mechanisms of ZB
against LC by network pharmacology.

Methods:
In this study, systemic network pharmacology was used to explore the underlying mechanism
of ZB, including pivotal components collection, target prediction, networks construction, Gene
Ontology (GO), and Kyoto Encyclopedia of Genes and Genomes (KEGG) pathway enrichment
analyses. At last, molecular docking was carried out to elucidate the involved pharmacological
mechanisms.

Results:
Twenty-eight potential active compounds with 317 related targets and 598 LC-related targets
were collected. Finally, 79 intersection targets were obtained use GO and KEGG pathway enrichment
analyses. Based on component-target-pathway network, quercetin, β-sitosterol, and β-
amyrin, and 6 targets were selected, including RAC-alpha serine/thre-onine-protein kinase (AKT1),
mitogen-active protein kinase1 (MAPK1), Transcription factor p65 (RELA), Caspase-9 (CASP9),
G1/S-specifi cyclin-D1 (CCND1), and PI3-kinase subunit gamma (PIK3CG); these six predicted
targets were highly involved in the PI3K-AKT signaling pathway.

Conclusion:
The active ingredients and mechanisms of ZB against LC were firstly investigated using
network pharmacology. This work provides scientific evidence to support the clinical effect of
ZB on LC, new insights into the anti-LC mechanism of ZB, and guidance for further study.
Social Environment as a Precursor to Coronary Artery Disease in a Small, Resource-Limited Country
Authors: Bahall Mandreker 
Published: July 2022

Background:
Coronary artery disease has been the most prevalent chronic disease over the last two decades. In Trinidad and Tobago—a small, high-income, resource-limited country the median age of presentation of, and premature death from, acute myocardial infarction is more than 12 years earlier to that in high-income, developed countries. This may be attributed to the increased risk of coronary artery disease that stem from the presence of precursors in the social environment.

Objective:
We aimed to explore the association between “social environment” and coronary artery disease in Trinidad and Tobago.

Methods:
This is a descriptive ecological study that assessed secondary data. Data were collected from multiple search engines and websites. Data on Trinidad and Tobago’s social environment were also accessed from the World Databank and the Central Intelligence Agency fact book and analyzed.

Results:
Coronary artery disease was fueled by personal choices that were influenced by the social environment (“fast food” outlets, inadequate sporting facilities, increased use of activity-saving tools [vehicles, phones, and online activities], smoking and alcohol accessibility, and social stressors [murder, family disputes, divorce, child abuse, kidnapping, and rape]). Food imports, as a percentage of merchandise imports, were at 11.42% (2015); the level of physical activity was low (<600 MET-minutes per week; 38 in 2016), and social stressors were high.

Conclusion:
The social environment has encouraged a “cardiotoxic” or “atherogenic” environment influencing behavior, eventually resulting in a continued high risk of coronary artery disease, presenting at a younger age.
A Mechanistic Study of the Antibacterial Activity of Phytoconstituents of
Pyracantha crenulata by Using Molecular Docking Studies
Authors: Bisht Gunjan , Singh Ankit Kumar , Kumar Adarsh , Kumar Pradeep 
Published: July 2022

Background:
Bacteria cause various infections and are a threat to the health system.
This threat is increased due to the resistance of bacteria towards antibacterial drugs. Plants are an
important source of drugs including antibacterial agents. Pyracantha crenulata is one important
plant known for its different medicinal uses. It contains different phytoconstituents responsible for
its medicinal properties.
In cholera, ToxT (PDB ID: 3GBG) regulates the expression of virulence factors in Vibrio cholerae.
FtsZ (PDB ID: 6RVN) is a protein involved in cell division and septal wall synthesis in bacteria.
MurA (PDB ID: 3SWQ) is critical for the biosynthesis of the bacterial cell wall. Flavin
mononucleotide (FMN) (PDB ID: 3F2Q) is involved in the biosynthesis and transport of several
protein cofactors. In most of the studies on phytoconstituents, the mechanism of action is not
described. Therefore, in this study, the above target proteins were selected and specific target
inhibitors were used as standard drugs. In light of the above-mentioned facts, we have proposed a
mechanism of antibacterial action of phytoconstituents of Pyracantha crenulata based on
molecular docking studies.

Objective:
To propose a mechanism of antibacterial action of phytoconstituents of Pyracantha
crenulata based on molecular docking studies.

Methods:
Molecular docking studies of phytoconstituents of Pyracantha crenulata were performed
using the Maestro 12.8 module of Schrodinger software

Results:
Molecular docking results indicated that many constituents including rutin and phloridzin
had better dock scores than standard drugs against different antibacterial targets.

Conclusion:
From the molecular docking, different constituents may act as good inhibitors of
different proteins like phloridzin may act as potent inhibitors of 3GBG, 6RVN, and 3SWQ, which
can be used further for the development of new antibacterial agents
Playground Inclusivity for Children With a Disability: Protocol for a Scoping Review
Authors: Taylor Leah G , Vanderloo Leigh M , Arbour-Nicitopoulos Kelly P , Leo Jennifer , Gilliland Jason , Tucker Patricia 
Published: July 2022

Background
Although playgrounds are designed to promote outdoor play, children with disabilities may be unable to engage in these spaces due to intrinsic and extrinsic factors. Previous research has examined inclusive/accessible playground design when developing new playgrounds; however, it is unclear if there is a best-practice tool for evaluating the inclusivity of existing playground structures.

Objective
A scoping review of both peer-reviewed and grey literature will be employed to explore evaluation tools for playground inclusivity, to enable the participation of children with disabilities.

Methods
The conduct of this study will adhere to the PRISMA-ScR (Preferred Reporting Items for Systematic Reviews and Meta-Analyses extension for Scoping Reviews) guidelines. A search for peer-reviewed research studies will be conducted in the following electronic databases: MEDLINE, Scopus, CINAHL, and Embase. Grey literature will be examined via a three-step process: (1) a search in the Canadian Health Research Collection Database; (2) a targeted Google search; and (3) reference list searching. Titles, abstracts, keywords, and full texts of identified studies will be independently screened for inclusion by two reviewers. A synthesis of included articles will describe the publication and auditing tool details. A summary of the findings will highlight the types of playgrounds measured, types of disability considered, measures of inclusion used, and psychometric properties.

Results
Database searches for peer-reviewed articles were completed in December 2021. A total of 1471 unique records were returned after the removal of 559 duplicate records. Full texts of 167 studies meeting eligibility criteria will be reviewed. The peer-reviewed research search will guide the grey literature search. The scoping review is planned for completion in 2022.

Conclusions
A rigorous search of the literature will determine the availability of tools for evaluating existing playground structures for the inclusivity of children with disabilities. The results will inform recommendations on tool applications, and applicable knowledge translation activities.

International Registered Report Identifier (IRRID)
DERR1-10.2196/37312
Changing Hearts and Minds: Evidence from a Symposium on Diversity, Equity, and Inclusion
Authors: Booker Danielle , Cook Kirsten A. , Wu Yi-Jing 
Published: July 2022

ABSTRACT
The accounting profession and academic institutions have expressed solidarity with diversity, equity, and inclusion (DEI) principles and recognize the importance of DEI programs in pedagogy to enhance students’ and new accounting professionals’ awareness of DEI issues specifically related to race. However, despite the collective acknowledgement by the accounting profession and academic institutions regarding the importance of DEI, no research, to our knowledge, in business or accounting higher education literature has empirically evaluated the effectiveness of specific DEI programming for enhancing students’ awareness of and attitudes toward racial issues. We fill the gap by investigating the effectiveness of a diversity symposium and a reflective writing exercise on undergraduate accounting students’ awareness and attitudes regarding racial issues. Our results suggest that both pedagogical interventions incrementally improve students’ knowledge and understanding of these issues. Our results have important implications for accounting higher education by providing implementable methods to enhance student awareness and attitudes.
Integrating Data Analytics into the Accounting Curriculum: Faculty Perceptions and Insights
Authors: Losi Heather J. , Isaacson Elena V. , Boyle Douglas M. 
Published: July 2022

ABSTRACT
Over the past decade, many stakeholder groups have explored how to integrate data analytics into the accounting curriculum. This study expands that literature by surveying 321 accounting faculty regarding their perspectives on the effectiveness of data analytics implementation. We examine curriculum development, course assessment, students' abilities, and faculty skills to design and teach such courses. We identify specific gaps in the accounting curriculum where further data analytics integration may be considered. We find several challenges to integration and support for infusing analytics skills earlier in the accounting curriculum. Accounting departments should consider the expertise of their faculty, especially assistant professors, who seem to have more knowledge of data analytics than any other rank, and focus on implementing specific data analytics skills throughout the accounting curriculum. We also provide proposed action items that will help accounting departments evaluate curriculum and related resource requirements.
Eosinofil Sel Penyaji Antigen
Authors: Jatmiko Safari Wahyu 
Published: July 2022

Sel eosinofil merupakan jenis sel lekosit yang terlibat dalam berbagai patogenesis penyakit. Sel eosinofil pada awalnya dikenal sebagai sel efektor dari sistem imunitas alamiah. Akan tetapi, kemampuan sel eosinofil dalam memfagositosis patogen menimbulkan dugaan bahwa sel eosinofil ikut berperan sebagai sel penyaji antigen. Hal ini dianalogikan dengan sel makrofag dan sel dendritik yang bisa memfagositosis dan menyajikan antigen sebagai hasil dari degradasi patogen yang difagositosis. Untuk menjawab permasalahan ini, penulis melakukan penelusuran artikel tentang eosinofil sebagai sel penyaji antigen melalui US National Library of Medicine National Institute of Healthdengan kata kunci eoshinophil dan antigen presenting cell. Hasil penelusuran adalah ditemukannya 10 artikel yang relevan dengan topik. Hasil dari sintesis kesepuluh jurnal tersebut adalah sel eosinofil mampu berperan sebagai sel penyaji antigen yang profesional (professionalantigenpresentng cell)
Autekologi Elephantopus scaber L. di Kebun Raya Purwodadi
Authors: Solikin Solikin 
Published: July 2022

Elephantopus scaber adalah jenis tumbuhan berkhasiat obat yang banyak tumbuh liar di Kebun Raya Purwodadi. Penelitian yang bertujuan untuk mempelajari ekologi Elephantopus scaber di Kebun Raya Purwodadi dilakukan dengan mengamati iklim dan tanah serta komposisi jenis tumbuhan di sekitarnya. Untuk menentukan komposisi jenis pada komunitas tempat Elephantopus scaber maka dilakukan pengamatan pada lokasi : (a) penetrasi cahaya 100% (terbuka), (b) penetrasi cahaya 26-50% (agak terbuka) dan (c) penetrasi cahaya 5-25%(agak teduh). Analisis vegetasi pada masing-masing lokasi dilakukan dengan membuat plot pada lokasi terpilih secara sistematis dengan menggunakan metode garis sepanjang 1 m sebanyak 50 segmen garis; jarak antar segmen 0,5 m. Hasil penelitian menunjukkan bahwa Elephantopus scaber tumbuh tersebar di tempat agak teduh hingga terbuka pada intensitas cahaya 100 – 10.000 footcandle. Elephantopus scaber paling banyak ditemukan pada lokasi agak terbuka dengan nilai Indeks Nilai Penting 105,96. Vegetasi pada tempat agak teduh dan agak terbuka habitat Elephantopus scaber relatif homogen yang didominasi oleh jenis rumput Axonopus compressus.
Inventarisasi Tanaman Buah Di Kawasan Taman Buah Kebun Raya Liwa
Authors: Chrisnawati Lili , Putri Ayu Sasqia , Haryanto Haryanto 
Published: July 2022

The Liwa Botanical Garden is one of the new botanical gardens in the Southern Sumatra. Data accuracy is needed in supporting the function of the Liwa Botanical Garden as an ex-situ conservation center. This study aims to obtain data on the diversity of fruit trees in the Liwa Botanical Garden. The inventory results show there are 12 tribes and 15 species of fruit trees, with a total of 572 specimens. The predominant genus is Myrtaceae (46%) and the species most commonly found is Psidium guava L. (25%). Kebun Raya Liwa adalah salah satu kebun raya baru di kawasan Sumatera Bagian Selatan. Akurasi data diperlukan dalam menunjang fungsi Kebun Raya Liwa sebagai pusat konservasi ex-situ. Studi ini bertujuan untuk memperoleh data keanekaragaman tanaman buah di kawasan taman buah Kebun Raya Liwa. Hasil inventarisasi menunjukkan terdapat 12 suku dan 15 jenis tanaman buah, dengan total keseluruhan mencapai 572 spesimen. Suku yang mendominasi adalah Myrtaceae (46%) dan jenis yang banyak ditemukan adalah Psidium gujava L. (25%).