cometadata/datacite-rtg-text-other-reclassification-records huggingface dataset:
Additional file 1 of The Mediator Subunit OsMED16 Interacts with the WRKY Transcription Factor OsWRKY45 to Enhance Rice Resistance Against Magnaporthe oryzae
Creators: name: Wu, Yanfei
name: Fu, Yuquan
name: Zhu, Zhonglin
name: Hu, Qin
name: Sheng, Feng
name: Du, Xuezhu
Publisher: name: figshare
Year: 2024
Subjects: subject: Genetics
subject: FOS: Biological sciences

description: Additional file 1. Fig. S1. The homozygous of CRISPR/cas9 edited OsMED16 plants caused seedling lethality. Fig. S2. Phylogenetic tree of MED16 proteins. Fig. S3. Mapping of the pU1301-1-CaMV35S-OsMED16-Flag overexpression vector. Fig. S4. Mapping of CRISPR/Cas9-Osmed16 knockout vectors. Fig.S5. Diagram of Pbait-ABAi-Pro.CYP99A3, Pbait-ABAi-ProKSL10, Pbait-ABAi-Pro.DPF vector construction. Fig. S6. Screening assay for optimal concentrations to suppress bait reporter strains. Fig. S7. Diagram of carrier modification for pGreen II 62-SK. Fig. S8. OsMED16 positively regulates rice resistance to rice blast via modulating H2O2 biosynthesis. Fig. S9. The analysis and cloning of promoters of H2O2 synthesis and degradation-related genes. Fig. S10. The H2O2 synthesis and degradation-related genes promoter activation were not dependent on the OsMED16-OSWRKY45 pathway. Fig. S11. OsMED16 not interacting with Pro.CYP99A3, Pro.KSL10, Pro.DPF. Fig. S12. Analysis of the effects of OsWRKY45+OsWRKY62 and OsWRKY45+OsWRKY62+OsMED16 on proOsCYP99A3, proOsKSL10 and proOsDPF. Fig. S13 Analysis of effects of Ev, OsWRKY45, OsMED16+OsWRKY45 and OsMED16+OsWRKY45/OsWRKY62 on proOsCYP99A3, proOsKSL10 and proOsDPF, respectively, detected in one leaf.
Electronic and magnetic properties of transition metal embedded MoSe2 monolayer and their gas adsorption
Creators: name: Su, Peng
name: Yu, Jiahui
name: Wang, Dongchao
Publisher: name: Taylor & Francis
Year: 2025
Subjects: subject: Biophysics
subject: Physical Sciences not elsewhere classified
subject: Physiology
subject: FOS: Biological sciences
subject: Biotechnology
subject: Environmental Sciences not elsewhere classified
subject: Chemical Sciences not elsewhere classified

description: The structural, electronic, and magnetic properties of transition metal (Ag, Au, Fe, and Pt)-embedded MoSe2 monolayers, as well as their gas adsorption characteristics for CO and NO molecules have been systematically investigated using density functional theory. The results reveal that the embedded transition metals can significantly alter the electronic and magnetic properties of the MoSe2 monolayer. Specifically, Ag, Au, and Fe atoms induce magnetic behaviour in the nonmagnetic MoSe2 surface, with Fe-embedded MoSe2 exhibiting the highest magnetic moment. The adsorption of CO and NO molecules leads to further changes in the electronic structure and magnetic properties, with Fe-embedded MoSe2 showing a transition from magnetic to nonmagnetic upon CO adsorption and Pt-embedded MoSe2 becoming magnetic upon NO adsorption. These findings provide valuable insights for the design of spin-based devices and gas sensors.
A computational model of the interaction of neurobiological circuits for category learning
Creators: name: Lim, Li Xin
Publisher: name: Purdue University Graduate School
Year: 2020
Subjects: Cognitive neuroscience

description: The goal of this proposal is to design a neurobiologically-based model that describes the switching mechanism in category learning based on existing category learning theory and model. COVIS is a neurobiologically-detailed theory of multiple systems in category learning. COVIS postulates two systems that compete throughout learning—a frontal-based declarative hypothesis-testing system that uses logical reasoning and depends on working memory and executive attention, and a basal ganglia-mediated system that uses procedural learning. However, no biological mechanism has been proposed to account for the interaction between the COVIS systems. We propose a model that employs a neurobiological-based circuit that describes the interaction and switching between the hypothesis-testing system and the procedural learning systems in COVIS. With the hypothesis-testing system and procedural learning system modeled as black boxes, the model focuses on the network that facilitates switching. In COVIS, both learning systems generate a response signal in each trial based on the stimuli given. Our model incorporates the Izhikevich firing model that represents the activity of the neuronal cells from the hyperdirect pathway of the cortico-basal ganglia network. The hyperdirect pathway acts as a gate for the response signal of the procedural learning system to reach the premotor units for action selection. We propose that the procedural learning system’s response is inhibited from approaching the premotor units when the hypothesis-testing system is in control of the response. However, if rule-based strategies fail, inhibition to the procedural system’s response is reduced. The reduction in inhibition results in the acceptance of responses from both learning systems in the premotor units. To validate the proposed model, we fit the model to two groups of participants in a perceptual category-learning task. One group of participants used the optimal procedural strategy in the task and the other used a suboptimal rule-based strategy. The categorization task was an information-integration task, whereby participants had to switch away from rule-based strategies and learn to integrate the stimulus dimensions to be able to perform optimally. We were able to differentiate the switchers from the non-switchers by adjusting the parameters in the model. In addition, we fitted another task to the model in which participants from different age groups with or without Parkinson’s disease were asked to switch between rule-based and procedural strategies on a trial-by-trial basis. We were able to match the learning curve, accuracy switch cost, and proportion of switchers of the different groups of participants.
sj-docx-1-pss-10.1177_09567976211005465 – Supplemental material for Acute Psychosocial Stress Increases Cognitive-Effort Avoidance
Creators: name: Bogdanov, Mario
name: Nitschke, Jonas P.
name: LoParco, Sophia
name: Bartz, Jennifer A.
name: Otto, A. Ross
Publisher: name: SAGE Journals
Year: 2021
Subjects: subject: 110904 Neurology and Neuromuscular Diseases
subject: FOS: Clinical medicine
subject: 170199 Psychology not elsewhere classified
subject: FOS: Psychology
subject: 110319 Psychiatry (incl. Psychotherapy)
subject: Neuroscience

description: Supplemental material, sj-docx-1-pss-10.1177_09567976211005465 for Acute Psychosocial Stress Increases Cognitive-Effort Avoidance by Mario Bogdanov, Jonas P. Nitschke, Sophia LoParco, Jennifer A. Bartz and A. Ross Otto in Psychological Science
sj-pdf-1-asp-10.1177_00037028211036761 - Supplemental material for Infrared Refraction Spectroscopy
Creators: name: Mayerhöfer, Thomas G.
name: Ivanovski, Vladimir
name: Popp, Jürgen
Publisher: name: SAGE Journals
Year: 2021
Subjects: subject: 99999 Engineering not elsewhere classified
subject: FOS: Other engineering and technologies

description: Supplemental material, sj-pdf-1-asp-10.1177_00037028211036761 for Infrared Refraction Spectroscopy by Thomas G. Mayerhöfer, Vladimir Ivanovski and Jürgen Popp in Applied Spectroscopy
Nature of metal–bis(β-diketonate) bonds in TM(acac’)2 (acac’ = acetylacetonate, hexafluoroacetylacetonate, hexamethylacetylacetonate; TM = Ni(II), Pd(II), Pt(II)) complexes: A density functional theory investigation
Creators: name: Gholiee, Yasin
Publisher: name: Taylor & Francis
Year: 2024
Subjects: Biophysics
Biochemistry
Medicine
Environmental Sciences not elsewhere classified
Chemical Sciences not elsewhere classified
Biological Sciences not elsewhere classified
Information Systems not elsewhere classified

description: This computational study investigates the structural and bonding aspects of transition metal bis(β-diketonate) complexes, TM(acac’)2 (acac’ = acetylacetonate, hexafluoroacetylacetonate, hexamethylacetylacetonate; TM = Ni(II), Pd(II), Pt(II)), at BP86/def2-TZVP and M06/def2-TZVP levels of theory. Patterns observed in both computed interaction and stabilisation energies demonstrate an increasing in the order of hexafluoroacetylacetonate < hexamethylacetylacetonate < acetylacetonate. A comprehensive energy decomposition analysis (EDA) was performed to thoroughly examine the attributes of the bonds between the metal and ligands within complexes. According to the EDA results, it is evident that electrostatic interactions exert a greater influence on shaping the overall attractive interactions compared to orbital interactions. However, the significance of the b1g orbitals cannot be overstated, as they contribute more than 41% across all complexes. Additionally, the backdonation processes TM→Lσ and TM→Lπ exhibit notable weaknesses.
Additional file 2 of The Mediator Subunit OsMED16 Interacts with the WRKY Transcription Factor OsWRKY45 to Enhance Rice Resistance Against Magnaporthe oryzae
Creators: name: Wu, Yanfei
name: Fu, Yuquan
name: Zhu, Zhonglin
name: Hu, Qin
name: Sheng, Feng
name: Du, Xuezhu
Publisher: name: figshare
Year: 2024
Subjects: subject: Genetics
subject: FOS: Biological sciences

description: Additional file 2. Table S1. Primer used in this study.
sj-docx-2-cjo-10.1177_00084174211034938 - Supplemental material for Evaluating a Therapeutic Powered Mobility Camp for Children with Severe Cerebral Palsy
Creators: name: Rosenberg, Lori
name: Maeir, Adina
name: Gilboa, Yafit
Publisher: name: SAGE Journals
Year: 2021
Subjects: subject: 111708 Health and Community Services
subject: FOS: Health sciences

description: Supplemental material, sj-docx-2-cjo-10.1177_00084174211034938 for Evaluating a Therapeutic Powered Mobility Camp for Children with Severe Cerebral Palsy by Lori Rosenberg, Adina Maeir and Yafit Gilboa in Canadian Journal of Occupational Therapy
"THE HEALTH-IMPROVING IMPORTANCE OF ACTION GAMES IN ELEMENTARY SCHOOL STUDENTS"
Creators: name: Ulugbekova, Munisa
Publisher: name: Zenodo
Year: 2025

description: this article explores the health-improving benefits of action games for elementary school students, highlighting their potential for increasing physical, mental, and social well-being. It discusses how engaging in action-oriented play can contribute to improving motor skills, coordination, and overall fitness among young learners. In addition, the article highlights the cognitive benefits of action games such as problem-solving skills, spatial awareness, and quick decision-making skills. Socially, these games can promote teamwork and communication among peers, encourage positive interactions, and shape social skills. The article concludes by promoting the inclusion of action games in educational settings as a means to support the holistic development of children, while making learning enjoyable and fun.
Theoretical perspective for molecular folding degree and heavy atom effect on room temperature phosphorescence properties
Creators: name: Sun, Xueyan
name: Liu, Huanling
name: Wang, Yan
name: Song, Yuzhi
name: Lin, Lili
name: Fan, Jianzhong
name: Xu, Yuanyuan
Publisher: name: Taylor & Francis
Year: 2024
Subjects: subject: Biophysics
subject: Physical Sciences not elsewhere classified
subject: Biotechnology
subject: Chemical Sciences not elsewhere classified
subject: Sociology
subject: FOS: Sociology
subject: Biological Sciences not elsewhere classified

description: Since room temperature phosphorescence (RTP) molecules typically exhibit small spin–orbit coupling (SOC) effect and a rapid non-radiative decay process, achieving efficient RTP emission is challenging. Therefore, it is imperative to enhance the SOC constant to facilitate efficient RTP and related structure–property relationship needs to be clarified. Herein, based on first-principle calculations, this paper elucidates the impact of molecular folding structure on SOC and RTP efficiency, excited state properties and exciton conversion processes are detailed studied. Results indicate that both the heavy atom effect and folding degree affect the SOC constants and the latter factor plays a dominate role than the former for studied systems. In addition, the intermolecular interactions can inhibit the geometric changes, decrease the reorganisation energies and increase transition dipole moment, thus the radiative decay rates are increased and non-radiative decay rates are decreased, efficient RTP emissions are realised for TA and PX molecules, no emission feature is determined for DX, previous experimental measurements are reasonably illustrated. These findings reveal the inner relationship among molecular folding structure, environmental effects and RTP performance. This study offers a theoretical perspective for elucidating the mechanism underlying fold-induced RTP enhancement, which provides an innovative molecular design strategy for developing efficient RTP emitters.
Modeling Biomass Transport in a Compression Screw Feeder
Creators: name: Gasteyer, Nathaniel Hall
Publisher: name: Purdue University Graduate School
Year: 2020
Subjects: Mechanical engineering not elsewhere classified

description: Biorefineries which seek to convert biomass into ethanol face many different challenges, and among them, mechanical failure of equipment is common. Unfortunately, the resulting downtime can significantly reduce the profitability and the viability of bioethanol plants. One important piece of mechanical equipment in this setting is the compression screw feeder, which is used both to convey and compress biomass into pressurized chemical reactors. However, due to the variability of feedstock properties, this feeding operation is challenging. An analytical model for predicting the operational steady-state torque of a compression screw feeder can assist the identification of optimal processing conditions, as well as predict and prevent equipment failure.
 Since these models have not yet been proposed, this thesis restricts attention to milled corn stover and investigates the application of the discrete element method (DEM) and analytical techniques to develop predictive models for the stresses and torques developed inside a compression screw feeder. Specifically, DEM simulations are used to identify and study the stresses within the different sections of a representative compression screw feeder for three backpressures, three screw pitches, and three internal friction angles. Using these numerical results, a suite of analytical models is then developed to predict the operational torque required to drive the screw feeder. In this thesis, the DEM results are also used in lieu of experimental data to provide a point of comparison for the models. The analytical models predict stresses on the correct order of magnitude and are not prohibitively sensitive to input properties, but the operational steady-state torque is overpredicted by the model in all cases. The mispredictions of the model are likely due to the assumption of constant material properties along the densification process, and the assumption of hydrostatic conditions throughout the compression screw feeder (especially near the boundaries). Despite these limiting assumptions, the proposed procedure for calculating the torque provides a first-order estimate of the required screw torque, demonstrates the sensitivity of the screw feeder to different inputs, and outlines the necessary steps to improve the model. The DEM simulations proved an invaluable tool in analyzing the behavior of bulk material within a compression screw feeder, but more experiments and simulations (possibly using the finite element method) are needed to further understand the biomass feeding operation.
Studying the influence of electron donor-withdraw groups on the photophysical properties of 3-arylthioimidazo[1,2-a]pyridines: experimental and theoretical study
Creators: name: dos Santos, Carlos H. D.
name: Silva, Daniel L.
name: Le Bescont, Julie
name: Breton-Patient, Chloé
name: Piguel, Sandrine
name: De Boni, Leonardo
Publisher: name: Taylor & Francis
Year: 2024
Subjects: subject: Biophysics
subject: Space Science
subject: Physical Sciences not elsewhere classified
subject: Biotechnology
subject: Evolutionary Biology
subject: FOS: Biological sciences
subject: Chemical Sciences not elsewhere classified

description: Imidazo[1,2-a]pyridine derivatives have received great attention in recent years in various fields such as pharmaceuticals and material sciences, to a lesser extent, thanks to the great flexibility to incorporate different peripheral groups. With the advance in chemical synthesis routes, a large number of substituted imidazo[1,2-a]pyridines have been developed but are still to be investigated as new optical materials. Therefore, we performed a spectroscopy study for a set of nine substituted 3-arylthioimidazo[1,2-a]pyridine derivatives with different peripheral groups to reveal their structure-optical property relationships and gain a deeper understanding of the influence of the nature of the substitution. The photophysical measurements include linear absorption, fluorescence emission, quantum yield, fluorescence lifetime, anisotropy and solvatochromism. The results showed that these optical properties can be modulated by changing the position and/or nature of the peripheral groups. For example, the fluorescence quantum yield values can increase c.a. ten-fold, which is vital for fluorescent applications, and the permanent dipole moment difference at the first excited state (Δμ01) increased c.a. five-fold. Moreover, the performance of quantum chemical calculations using the Density Functional Theory and a polarisable continuum solvation model allowed us to understand the electronic transitions and charge transfer of the derivatives investigated.
sj-pdf-3-msj-10.1177_13524585211035740 – Supplemental material for Ocrelizumab treatment for relapsing-remitting multiple sclerosis after a suboptimal response to previous disease-modifying therapy: A nonrandomized controlled trial
Creators: name: Weinstock-Guttman, Bianca
name: Bermel, Robert
name: Cutter, Gary
name: Freedman, Mark S
name: Leist, Thomas P
name: Ma, Xiaoye
name: Kile, Deidre
name: Musch, Bruno
name: Reder, Anthony T
name: Wolinsky, Jerry S
Publisher: name: SAGE Journals
Year: 2021
Subjects: subject: 110904 Neurology and Neuromuscular Diseases
subject: FOS: Clinical medicine
subject: 111702 Aged Health Care
subject: FOS: Health sciences

description: Supplemental material, sj-pdf-3-msj-10.1177_13524585211035740 for Ocrelizumab treatment for relapsing-remitting multiple sclerosis after a suboptimal response to previous disease-modifying therapy: A nonrandomized controlled trial by Bianca Weinstock-Guttman, Robert Bermel, Gary Cutter, Mark S Freedman, Thomas P Leist, Xiaoye Ma, Deidre Kile, Bruno Musch, Anthony T Reder and Jerry S Wolinsky in Multiple Sclerosis Journal
Additional file 1 of Neutral effects of SGLT2 inhibitors in acute coronary syndromes, peripheral arterial occlusive disease, or ischemic stroke: a meta-analysis of randomized controlled trials
Creators: name: Tsai, Pei-Chien
name: Chuang, Wei-Jung
name: Ko, Albert Min-Shan
name: Chen, Jui-Shuan
name: Chiu, Cheng-Hsun
name: Chen, Chun-Han
name: Yeh, Yung-Hsin
Publisher: name: figshare
Year: 2024
Subjects: Medicine
Biotechnology
Chemical Sciences not elsewhere classified
Marine Biology
Science Policy

description: Additional file 1. Database search algorithm.
An ab initio study of the electronic structure and spectroscopy of CO+ and CS+ diatomic cations
Creators: name: Boulama, Abel
name: Vamhindi, Berthelot Saïd Duvalier Ramlina
name: Nsangou, Mama
Publisher: name: Taylor & Francis
Year: 2025
Subjects: subject: Biochemistry
subject: Physical Sciences not elsewhere classified
subject: Cell Biology
subject: Pharmacology
subject: Biotechnology
subject: Chemical Sciences not elsewhere classified
subject: Immunology
subject: FOS: Clinical medicine
subject: Marine Biology
subject: Cancer
subject: Infectious Diseases
subject: FOS: Health sciences
subject: Computational Biology

description: In this study, accurate ab initio methods are used to determine the electronic structure and spectroscopic properties of CS+ and CO+ cations of astrophysical relevance. The core-valence, scalar relativistic and complete basis set extrapolation (CBS) corrections are used in conjunction with the multireference configuration interaction method to obtain accurate properties. The results obtained are very satisfactory in comparison with the experiment. The potential energy curves have been plotted up to reasonable distances, allowing their asymptotes to be adequately described. The ionisation potentials of the neutral molecules were determined. They are 11.26 eV and 14.02 eV for CS and CO respectively. The vibrational energy levels and the rotational constants are also calculated. Our values are in very good agreement compared with the experiment. For instance, we have G(0)=686.550cm−1 for the ground state X2Σ+(CS+), while the experimental value is 686.841cm−1. New data for G(0) and for the rotational constants of the other states are proposed. The Franck-Condon Factors values computed are in perfect agreement with the experimental ones and this implies an accurate description of the transition properties and the radiative lifetimes.
UNDERSTANDING THE RELATIONSHIP BETWEEN TEAM DYNAMICS ON PEER EVALUATIONS AND TEAM EFFECTIVENESS
Creators: name: Beigpourian, Behzad
Publisher: name: Purdue University Graduate School
Year: 2020
Subjects: Engineering practice
Other engineering not elsewhere classified
Other education not elsewhere classified
Higher education
Organisational behaviour

description: Engineering students are expected to develop professional skills in addition to their technical knowledge as outcomes of accredited engineering programs. Among the most critical professional skills is the ability to work effectively in a team. Working effectively in teams has learning benefits and also provides an environment for developing other professional skills such as communication, leadership skills, and time management. However, students will develop those skills only if their teams function effectively. This dissertation includes three studies that together inform team formation and management practices to improve team dynamics. The first study investigates mixed-gender team dynamics to determine whether those teams are realizing their potential. The second study explores the relationship of individual psychological safety and students’ team member effectiveness and the moderating effects of team-level psychological safety. The third study explores self-rating bias among first-year engineering students and its relationship to student characteristics and dimensions of team-member effectiveness. Although mixed-gender teams had equal team dynamics with all-male teams, more team facilitation and training are needed to improve the experience of mixed-gender teams. Asian, Black, and Hispanic/Latino students, as well as students with lower GPA, report lower psychological safety, which is associated with lower team-member effectiveness. Team-level psychological safety moderated this effect for Asian and Hispanic/Latino students. Students’ effort in teams was associated with lower self-rating bias, likely an indication of greater self-awareness. Together, these studies and their findings contribute to a broader understanding that there are interrelationships among team composition, team dynamics, and team-member effectiveness, and that these relationships differ based on student characteristics such as race/ethnicity, gender, and prior knowledge. This work adds to the body of research demonstrating the importance of teaching students about effective teamwork, conducting regular peer evaluations of team functioning, and interpreting those peer evaluations carefully to avoid perpetuating any biases. This work also demonstrates the usefulness of psychological safety as an important indicator of marginalization.
РОЛЬ ПЕДАГОГИЧЕСКИХ ПРОГРАММНЫХ СРЕДСТВ В САМОСТОЯТЕЛЬНОМ РАЗВИТИИ СТУДЕНТОВ В ИНФОРМАТИЗИРОВАННОЙ ОБРАЗОВАТЕЛЬНОЙ СРЕДЕ
Creators: name: Куденов, Темурбек
Publisher: name: Zenodo
Year: 2025

description: В данной статье исследуется роль педагогических программных средств (ППС) в развитии самостоятельного обучения и саморазвития в информационно-насыщенной образовательной среде. Рассматривается концепция ППС, их классификация и влияние на способность студентов самостоятельно направлять свое обучение, развивать навыки критического мышления и участвовать в совместной деятельности. В статье приводятся практические примеры применения ППС в различных дисциплинах и подчеркивается их значение в модернизации образования и расширении возможностей студентов.
Additional file 1 of Spatial analysis of outdoor indecent assault risk: a study using ambient population data
Creators: name: Adachi, Hiroki M.
name: Nakaya, Tomoki
Publisher: name: figshare
Year: 2024
Subjects: subject: Medicine
subject: Biotechnology
subject: Environmental Sciences not elsewhere classified
subject: Ecology
subject: FOS: Biological sciences
subject: Biological Sciences not elsewhere classified

description: Additional file 1: Geographic distributions of each factor (basis vector of NMF) in entire study area. Fig. A1. Factor1. Fig. A2. Factor2. Fig. A3. Factor 3. Fig. A4. Factor 4. Fig. A5. Factor 5. Fig. A6. Factor 6. Fig. A7. Factor 7. Fig. A8. Factor 8.
Can aurones act as photosensitizers for photodynamic therapy? A computational prediction based on density functional theory
Creators: name: Yeddou, Fatma Zohra Imene
name: Benmensour, Mohamed Ali
name: Amar, Anissa
Publisher: name: Taylor & Francis
Year: 2025
Subjects: subject: Biophysics
subject: Biochemistry
subject: Physiology
subject: FOS: Biological sciences
subject: Pharmacology
subject: Chemical Sciences not elsewhere classified
subject: Biological Sciences not elsewhere classified
subject: Cancer

description: Density functional theory (DFT) and time-dependent density functional theory (TDDFT) have been used with the B3LYP functional in this work on three experimental aurones derivatives 1-aurone (1a), 2-aurone (2a) and 3-aurone (3a) in order to theoretical predict whether they can act as photosensitizers. In addition, molecules 4-aurone (4a), 5-aurone (5a) and 6-aurone (6a) were proposed to elucidate the effect of Z/E isomers of 1a, 2a and 3a by switching the position of the carbonyl group and the endocyclic oxygen in each structure. The effect of substitution is further demonstrated by replacing the endocyclic oxygen in 1a with the methylamino group, sulphur or selenium atom, thereby forming the new compounds 7-aurone (7a), 8-aurone (8a) and 9-aurone (9a), respectively. The frontier molecular orbitals analysis and calculation of one-photon absorption properties are conducted using the 6-31G* basis set. The two-photon absorption properties and spin–orbit coupling constants (SOC) are computed with the 6-31G* basis. All calculations were repeated using the cc-pVDZ basis set and compared with the previous results to highlight the effect of the choice of basis set. The findings indicate that all molecules meet the standard of photosensitizer in photodynamic therapy. For instance, compound 7a possesses the largest SOC constant.
Are we teaching systems engineering students what they need to know?
Creators: name: Khoury, Tracy El
Publisher: name: Purdue University Graduate School
Year: 2020
Subjects: Aerospace engineering not elsewhere classified

description: This research addresses the need to advance systems engineering education, by assessing current undergraduate systems engineering programs in the US relative to the needs of the industry.
We extracted over 300 expressions relevant to the systems engineer’s duties from six sources. We chose sources that address the variety in how people define “systems engineering”, the evolving nature of the field, its practical aspect and the lessons learned through experience. We used these expressions to write 35 needed learning outcomes that should be taught to systems engineering students. The outcomes fall under six broad categories relating to requirements management, solution selection and implementation, system architecture and modeling, system performance evaluation, V&V activities and project management. We then looked at what existing undergraduate systems engineering programs are teaching and extracted each program’s current learning outcomes. We compared each program’s current outcomes to the industry-based needed outcomes to determine whether students are being taught what they need to know.
We learned that the duties of systems engineers are not uniquely defined and prioritized by the six sources, and that academic programs do not all teach the same outcomes. We found that allcurrent undergraduate systems engineering programs in the US are preparing students to meet at least some of the needs of the industry, such as to “Identify stakeholder needs”, “Develop highlevel system architecture” and “Estimate cost”, but that most programs do not teach students how to “Select optimal concept” or how to “Analyze system resilience”.
This work motivates the need to investigate potential gaps in systems engineering education and to determine how well we are preparing students to meet the needs of the industry.
sj-docx-1-isw-10.1177_00208728211022796 – Supplemental material for The perceived importance of educational qualifications and professional development/continuous education for social work administrators: A case of the NASW-KY chapter
Creators: name: Alaslawi, Hamad A
name: Garrett, Jeremiah K
Publisher: name: SAGE Journals
Year: 2021
Subjects: subject: 160512 Social Policy
subject: FOS: Political science

description: Supplemental material, sj-docx-1-isw-10.1177_00208728211022796 for The perceived importance of educational qualifications and professional development/continuous education for social work administrators: A case of the NASW-KY chapter by Hamad A Alaslawi and Jeremiah K Garrett in International Social Work
Computational insights into photo-induced behaviours for chalcogen doping 2-benzooxazol-2-yl-5-diethylamino-phenol derivatives
Creators: name: Jiang, Lai
name: Chen, Jiahe
name: Zhao, Yuhan
name: Zhang, Le
name: Wang, Yihan
name: Zhao, Jinfeng
Publisher: name: Taylor & Francis
Year: 2024
Subjects: subject: Biophysics
subject: Physical Sciences not elsewhere classified
subject: Medicine
subject: Neuroscience
subject: Evolutionary Biology
subject: FOS: Biological sciences
subject: Chemical Sciences not elsewhere classified
subject: Information Systems not elsewhere classified
subject: Plant Biology

description: In view of the distinguished photochemical and photobiological characteristics of 2-Benzooxazol-2-yl-5-diethylamino-phenol (BYDP) and its derivatives, herein, we mainly focus on probing into excited-state behaviours of the three chalcogen element substituted BYDP derivatives (i.e. BYDP-O, BYDP-S and BYDP-Se). For these three different fluorophores, we detangle the effects of atomic electronegativity and charge recombination related to oxygen elements in excited-state intramolecular proton-transfer (ESIPT) processes. Because of the low potential energy barriers, we confirm that the ESIPT is controlled by atomic electronegativity. We sincerely hope our work could provide a theoretical reference for proving this novel mechanism of ESIPT experimentally.
Online supplementary file 1 - Supplemental material for Head Scanning Behavior Predicts Hazard Detection Safety Before Entering an Intersection
Creators: name: Savage, Steven W.
name: Zhang, Lily
name: Swan, Garrett
name: Bowers, Alex R.
Publisher: name: SAGE Journals
Year: 2021
Subjects: subject: 99999 Engineering not elsewhere classified
subject: FOS: Other engineering and technologies
subject: 170199 Psychology not elsewhere classified
subject: FOS: Psychology

description: Supplemental material, Online supplementary file 1, for Head Scanning Behavior Predicts Hazard Detection Safety Before Entering an Intersection by Steven W. Savage, Lily Zhang, Garrett Swan and Alex R. Bowers in Human Factors: The Journal of Human Factors and Ergonomics Society
A hydrazine-hydroxy-pyran-2-one derivatives as a potential anticancer and antibacterial agent: synthesis, spectroscopic, SC-XRD, DFT/TD-DFT, Hirshfeld surface analysis, in silico molecular docking and nonlinear optical responses studies
Creators: name: Yahiaoui, Messaoud
name: Tabti, Salima
name: Guerraoui, Abdenour
name: Djedouani, Amel
name: Hannachi, Douniazed
name: Laidoudi, Mouloud
name: Warad, Ismail
name: Stoeckli-Evans, Helen
name: Fleutot, Solenne
name: Almutairi, Tahani Mazyad
name: Islam, Mohammad Shahidul
Publisher: name: Taylor & Francis
Year: 2025
Subjects: Biochemistry
Pharmacology
Biotechnology
Chemical Sciences not elsewhere classified
Biological Sciences not elsewhere classified

description: This study presents the synthesis and thorough characterisation of a hydrazine-hydroxy-pyran-2-one derivative referred to as compound (L1: 3, 3′- [(1E.2E)-hydrazine-1, 2-diylidene-dieth-1-yl-1-ylidene] bis(4-hydroxy-6-methyl-2H-pyran-2-one). Structural elucidation using UV-vis, FT-IR and single crystal X-ray diffraction (SC-XRD) confirmed tautomeric forms of L1. The SC-XRD analysis revealed a bi-zwitterionic form (BZL1), stabilised by the intramolecular proton transfer between two enol units and azine tautomerism. The planar molecular structure, supported by XRD, DFT and Hirshfeld surface analysis, showed charge-assisted hydrogen bonds [N+−H…O−] forming S(6) ring motifs. Crystals were stabilised by C-H…O hydrogen bonds and π-π stacking, analysed through Hirshfeld surfaces and 2D fingerprint plots. Compound L2: 3-[(1E)-1-(9H-fluoren-9-ylidenehydrazinylidene)ethyl]-4-hydroxy-6-methyl-2H-pyran-2-one), is illustrated in this paper to compare two derivatives of dehydroacetic acid (DHA) and to enrich this study. Molecular docking revealed binding affinities of hybrid compounds with target proteins. DFT and TD-DFT analyses examined structural, electronic and optical properties, aligning well with experimental data. BZL1 exhibited higher electronic hardness (3.632 eV) than L2 (3.506 eV). Variations in α, Δα and ρ values were observed, with L1 showing stronger γ(0; 0, 0, 0) and γ(−ω; ω, 0, 0) while L2 excelled in γ(−2ω; ω, ω, 0). Consequently, these results highlight the potential of these compounds as promising candidates for use in third-order nonlinear optical applications.
sj-pdf-5-sgo-10.1177_21582440211040076 – Supplemental material for Bystander Affiliation Influences Intervention Behavior: A Virtual Reality Study
Creators: name: Rovira, Aitor
name: Southern, Richard
name: Swapp, David
name: Campbell, Claire
name: Zhang, Jian J.
name: Levine, Mark
name: Slater, Mel
Publisher: name: SAGE Journals
Year: 2021
Subjects: subject: 200199 Communication and Media Studies not elsewhere classified
subject: FOS: Media and communications
subject: 160299 Criminology not elsewhere classified
subject: FOS: Law
subject: Education
subject: 170199 Psychology not elsewhere classified
subject: FOS: Psychology
subject: Sociology
subject: FOS: Sociology

description: Supplemental material, sj-pdf-5-sgo-10.1177_21582440211040076 for Bystander Affiliation Influences Intervention Behavior: A Virtual Reality Study by Aitor Rovira, Richard Southern, David Swapp, Claire Campbell, Jian J. Zhang, Mark Levine and Mel Slater in SAGE Open
HARBIY TA'LIMDA KURSANTLARDA SOFT KO'NIKMALARNI RIVOJLANTIRISH AHAMIYATI
Creators: name: Soxiboyev, Zoyirjon
Publisher: name: Zenodo
Year: 2025

description: Ushbu maqolada oliy harbiy ta’lim bilim yurtlarida kursantlar bilan harbiy-pedagogik ta’lim jarayonini olib borishda “Soft Skills” (yumshoq) ko‘nikmalarning ijtimoiy-psixologik xususiyatlari, shuningdek kursantlarda ushbu ko‘nikmalarni rivojlantirishning ahamiyatli tomonlari yoritib berilgan.
Advancing Video Compression With Error Resilience And Content Analysis
Creators: name: Chen, Di
Publisher: name: Purdue University Graduate School
Year: 2020
Subjects: Electrical engineering not elsewhere classified

description: In this thesis, two aspects of video coding improvement are discussed, namely error resilience and coding efficiency. With the increasing amount of videos being created and consumed, better video compression tools are needed to provide reliable and fast transmission. Many popular video coding standards such as VPx, H.26x achieve video compression by using spa- tial and temporal dependencies in the source video signal. This makes the encoded bitstream vulnerable to errors during transmission. In this thesis, we investigate an error resilient video coding for the VP9 bitstreams using error resilience packets. An error resilient packet consists of encoded keyframe contents and the prediction sig- nals for each non-keyframe. Experimental results exhibit that our proposed method is effective under typical packet loss conditions. In the second part of the thesis, we first present an automatic stillness feature detection method for group of pictures. The encoder adaptively chooses the coding structure for each group of pictures based on its stillness feature to optimize the coding efficiency. Secondly, a content-based video coding method is proposed. Modern video codecs including the newly developed AOM/AV1 utilize hybrid coding techniques to remove spatial and temporal redundancy. However, the efficient exploitation of statistical dependencies measured by a mean squared error (MSE) does not always produce the best psychovisual result. One interesting approach is to only encode visually relevant information and use a different coding method for “perceptually insignificant” regions xiv in the frame. In this thesis, we introduce a texture analyzer before encoding the input sequences to identify detail irrelevant texture regions in the frame using convolutional neural networks. The texture region is then reconstructed based on one set of motion parameters. We show that for many standard test sets, the proposed method achieved significant data rate reductions.
ҲАРБИЙ УЧУВЧИЛАРНИНГ ПСИХОЛГИК ТАЙЁРГАРЛИГИ ТЎҒРИСИДА
Creators: name: Қўлдошев, Рашид
name: Рахманов, Шухрат
Publisher: name: Zenodo
Year: 2025

description: мақола чет давлатлар ҳарбий авиация мутахасисларининг касбий яроқлилик даражасини аниқлаш бўйича тажрибалари таҳлилига, шунингдек жанговар вазифани бажаришга ахлоқий-рухий тайёргарлигини аниқлашга бағишланган. Тарихда Россия мисолида, шунингдeк, Буюк Британия,  АҚШ, Германия, Италия, Франция ҳарбий авиациясида учувчилар таркибини психологик танлов жараёнига ҳамда баҳоланувчи тоифага тегишли табақалаштирилган йўналишни қўлланилишига урғу берилади.
Additional file 1 of “They seemed to be like cogs working in different directions”: a longitudinal qualitative study on Long COVID healthcare services in the United Kingdom from a person-centred lens
Creators: name: Fang, Chao
name: Baz, Sarah Akhtar
name: Sheard, Laura
name: Carpentieri, J. D.
Publisher: name: figshare
Year: 2024
Subjects: subject: Medicine
subject: Sociology
subject: FOS: Sociology
subject: Biological Sciences not elsewhere classified
subject: Cancer
subject: Science Policy
subject: Mental Health

description: Supplementary Material 1.
Insights into oxygen-substituted hydrogen bonding effects and ESIPT processes for 3,7-dihydroxy-4-oxo-2-phenyl-chroman-8-carbaldehyde fluorophores: a computational study
Creators: name: Zhen, Qi
name: Wang, Shufan
name: Liu, Xia
name: Chen, Jiahe
Publisher: name: Taylor & Francis
Year: 2025
Subjects: subject: Biophysics
subject: Physical Sciences not elsewhere classified
subject: Medicine
subject: Molecular Biology
subject: Biotechnology
subject: Chemical Sciences not elsewhere classified
subject: Biological Sciences not elsewhere classified
subject: Plant Biology
subject: FOS: Biological sciences
subject: Computational Biology

description: Flavonoid compounds own significant biological and pharmic applications, 3,7-Dihydroxy-4-oxo-2-phenyl-chroman-8-carbaldehyde (DPC) as one of the novel hydroxyl-flavone derivatives owns asymmetrical dual hydrogen bonding wires that present superior luminescent properties. Inspired by the regulated excited state dynamics by doping chalcogen elements, in this work, we mainly focus on clarifying the related excited state behaviours for three DPC derivatives (i.e. DPC, DPC-S and DPC-Se) theoretically. Detangling dual intramolecular hydrogen bonding interactions, photo-induced charge recombination, effects of atomic electronegativity related to oxygen elements, and relative excited state intramolecular proton transfer (ESIPT) behaviours, we mainly elaborate the chalcogen-element-related ESIPT mechanism for DPC derivatives. Based on our results, we sincerely wish our work could facilitate comprehending molecular excited state dynamics and designing novel luminescent organic materials for DPC derivatives.
sj-docx-1-qjp-10.1177_17470218211041953 – Supplemental material for Numeral order and the operationalization of the numerical system
Creators: name: Muñez, David
name: Orrantia, Josetxu
name: Matilla, Laura
name: Sanchez, Rosario
Publisher: name: SAGE Journals
Year: 2021
Subjects: subject: 170199 Psychology not elsewhere classified
subject: FOS: Psychology

description: Supplemental material, sj-docx-1-qjp-10.1177_17470218211041953 for Numeral order and the operationalization of the numerical system by David Muñez, Josetxu Orrantia, Laura Matilla and Rosario Sanchez in Quarterly Journal of Experimental Psychology
Additional file 2 of “They seemed to be like cogs working in different directions”: a longitudinal qualitative study on Long COVID healthcare services in the United Kingdom from a person-centred lens
Creators: name: Fang, Chao
name: Baz, Sarah Akhtar
name: Sheard, Laura
name: Carpentieri, J. D.
Publisher: name: figshare
Year: 2024
Subjects: subject: Medicine
subject: Sociology
subject: FOS: Sociology
subject: Biological Sciences not elsewhere classified
subject: Cancer
subject: Science Policy
subject: Mental Health

description: Supplementary Material 2.
sj-docx-1-cpa-10.1177_07067437211039790 - Supplemental material for Asthma Severity and Control and Their Association With Perinatal Mental Illness
Creators: name: Aker, Amira M.
name: Stephenson, Anne L.
name: Wilton, Andrew S.
name: Vigod, Simone N.
name: Dennis, Cindy-Lee
name: Guttmann, Astrid
name: Brown, Hilary K.
Publisher: name: SAGE Journals
Year: 2021
Subjects: subject: 170199 Psychology not elsewhere classified
subject: FOS: Psychology
subject: 110319 Psychiatry (incl. Psychotherapy)
subject: FOS: Clinical medicine

description: Supplemental material, sj-docx-1-cpa-10.1177_07067437211039790 for Asthma Severity and Control and Their Association With Perinatal Mental Illness by Amira M. Aker, Anne L. Stephenson, Andrew S. Wilton, Simone N. Vigod, Cindy-Lee Dennis, Astrid Guttmann and Hilary K. Brown in The Canadian Journal of Psychiatry
Digital Provenance Techniques and Applications
Creators: name: Jabal, Amani M Abu
Publisher: name: Purdue University Graduate School
Year: 2020
Subjects: Applied computing not elsewhere classified

description: This thesis describes a data provenance framework and other associated frameworks for utilizing provenance for data quality and reproducibility. We first identify the requirements for the design of a comprehensive provenance framework which can be applicable to various applications, supports a rich set of provenance metadata, and is interoperable with other provenance management systems. We then design and develop a provenance framework, called SimP, addressing such requirements. Next, we present four prominent applications and investigate how provenance data can be beneficial to such applications. The first application is the quality assessment of access control policies. Towards this, we design and implement the ProFact framework which uses provenance techniques for collecting comprehensive data about actions which were either triggered due to a network context or a user (i.e., a human or a device) action. Provenance data are used to determine whether the policies meet the quality requirements. ProFact includes two approaches for policy analysis: structure-based and classification-based. For the structure-based approach, we design tree structures to organize and assess the policy set efficiently. For the classification-based approach, we employ several classification techniques to learn the characteristics of policies and predict their quality. In addition, ProFact supports policy evolution and the assessment of its impact on the policy quality. The second application is workflow reproducibility. Towards this, we implement ProWS which is a provenance-based architecture for retrieving workflows. Specifically, ProWS transforms data provenance into workflows and then organizes data into a set of indexes to support efficient querying mechanisms. ProWS supports composite queries on three types of search criteria: keywords of workflow tasks, patterns of workflow structure, and metadata about workflows (e.g., how often a workflow was used). The third application is the access control policy reproducibility. Towards this, we propose a novel framework, Polisma, which generates attribute-based access control policies from data, namely from logs of historical access requests and their corresponding decisions. Polisma combines data mining, statistical, and machine learning techniques, and capitalizes on potential context information obtained from external sources (e.g., LDAP directories) to enhance the learning process. The fourth application is the policy reproducibility by utilizing knowledge and experience transferability. Towards this, we propose a novel framework, FLAP, which transfer attribute-based access control policies between different parties in a collaborative environment, while considering the challenges of minimal sharing of data and support policy adaptation to address conflict. All frameworks are evaluated with respect to performance and accuracy.
SHAPE-PRESERVING TRANSFORMATIONS OF BIO-ENABLED SILICA STRUCTURES FOR OPTICAL AND MECHANICAL APPLICATIONS
Creators: name: Hwang, Sunghwan
Publisher: name: Purdue University Graduate School
Year: 2021
Subjects: Materials engineering not elsewhere classified
Functional materials
Materials conservation

description: Bio-inorganic structures have been found to exhibit impressive optical and mechanical properties, such as control of light and/or high fracture strength. Certain species of diatoms (single-celled algae) form siliceous microshells (frustules) with organized structures that affect the transmission of light or fracture strengths. It has been found that Coscinodiscus wailesii diatoms have frustules with a quasi-regular hexagonal pattern of pores, which act as micro-lenses. In terms of mechanical strength, Fragilariopsis kerguelensis diatom SiO2 frustules have been observed to exhibit impressive compressive and tensile fracture stress values. In this study, shape-preserving chemical conversion (using gas/solid reactions) is used to transform biogenic structures (diatom frustules) into high IR refractive index or ultrahigh specific strength materials. High-fidelity MgO/Si, Mg2Si, Ca2Si, MgO/Ti, and Ti replicas are successfully synthesized and characterized by SEM, EDX, XRD, and TEM. Focal point imaging experiments are used to show that focusing behavior of MgO/Si and Mg2Si replicas can be enhanced in the IR range upon conversion into higher index replicas. Mechanical properties of SiO2 frustules, MgO/Ti replicas, and Ti replicas have been measured by using in-situ and ex-situ indentation, which revealed that the mechanical properties can be enhanced by the shape-preserved chemical conversion of Bio-inorganic structures.