jablonkagroup/rise_ai_scientists huggingface dataset:
Authors: Suman Basak | Anjan Borah | Bhagyashree Ramchiary
Source: Journal of Preventive Diagnostic and Treatment Strategies in Medicine (review, 2025-04-01)
Field: Materials Science — Electronic, Optical and Magnetic Materials

Surface Plasmon Resonance: A Comprehensive Review of Principles, Instrumentation, Analytical Procedures, and Pharmaceutical Applications Abstract A strong, label-free optical method called surface plasmon resonance (SPR) makes it possible to observe biomolecular interactions in real-time with remarkable sensitivity. By offering quantitative insights into binding kinetics and affinities without the use of fluorescent or radioactive labels, SPR has transformed biosensing, drug development, and materials research in recent decades. The basic ideas of SPR are examined in this thorough examination, which also covers its physics, equipment, and many configurations created to improve its analytical potential. The book also explores the wide range of SPR applications, including high-throughput drug screening, point-of-care diagnostics, membrane protein characterization, and investigating protein–ligand interactions. The sensitivity and adaptability of SPR-based systems have increased, thanks to developments such as SPR imaging, detection boosted by nanoparticles, and integration with microfluidics. Surface sensitivity, the possibility of nonspecific binding, and difficulties interpreting data are some of SPR’s drawbacks despite its numerous benefits. These issues are still being addressed by ongoing advancements in surface chemistry, equipment, and data interpretation, which expands the use of SPR in interdisciplinary research. To emphasize SPR’s crucial and developing significance in contemporary scientific research, the study finishes by emphasizing new developments, such as the integration of SPR with complementary analytical methods and the use of artificial intelligence for data processing. Instrumentation (computer programming) ; Surface plasmon resonance ; Nanotechnology ; Surface (topology) ; Computer science ; Materials science ; Mathematics ; Geometry Gold and Silver Nanoparticles Synthesis and Applications ; Advanced Biosensing Techniques and Applications ; Plasmonic and Surface Plasmon Research
Authors: Kota Moritake | Tomohiro Tsuchida | Ryotaro Koga | Kanji Hasegawa | Wataru Kuwashima | Hikaru Kataoka | Satoru Goto | Hiroshi Terada
Source: International Journal of Pharmaceutics (article, 2025-01-04)
Field: Chemistry — Organic Chemistry

Equilibrium of monomers, dimers, and polymeric aggregates in the α-aryl-propionic acid-type analgesics naproxen, ketoprofen, and ibuprofen: Comparative study with oxicam-type meloxicam and piroxicam Hydrophobicity is associated with drug transport across membranes and is expressed as the partition coefficient log P for neutral drugs and the distribution coefficient log D for acidic and basic drugs. The log P and log D predictions are deductively (or with artificial intelligence) estimated as the sum of the partial contributions of the scaffold and substituents of a single molecule and are used widely and affirmatively. However, their predictions have not always been comprehensively accurate beyond scaffold differences. For α-aryl propionic acid and oxicam-type analgesics, the pH profiles and methanol contents dependence on hydrophobicity were examined using reversed-phase HPLC, the conventional flask-shaking method. UV spectroscopy and singular value decomposition (SVD) were used to determine the acid dissociation constants. The dehydration of organic solutes in aqueous solutions by methanol rearranged their dispersion states. Therefore, their fluorescent excitation spectra switched dependently on the fluorophore's concentration, suggesting that α-aryl propionic acid-type analgesics reach equilibrium in monomers, dimers, and polymeric aggregations but the oxicam-type ones cannot achieve dimerization. Their dissolution behaviors are dominated by phenomenological processes, generating a type of dissipative structure that is adaptive to the features of individual solutes. The results of this study suggest that the apparent hydrophobicity of organic solutes is reflected in the dissolved state. Piroxicam ; Meloxicam ; Ketoprofen ; Naproxen ; Ibuprofen ; Mefenamic acid ; Chemistry ; Pharmacology ; Chromatography ; Medicine Chemical Thermodynamics and Molecular Structure ; Inflammatory mediators and NSAID effects ; Analytical Methods in Pharmaceuticals
Authors: Alberto Boretti
Source: Optical and Quantum Electronics (review, 2025-06-12)
Field: Materials Science — Materials Chemistry

A narrative review of breakthroughs and future horizons in zero-dimensional nanomaterials New horizons ; Nanomaterials ; Zero (linguistics) ; Narrative ; Narrative review ; Nanotechnology ; Physics ; Materials science ; Psychology ; Philosophy ; Astronomy ; Psychotherapist ; Linguistics 2D Materials and Applications ; Quantum Dots Synthesis And Properties ; Advanced Photocatalysis Techniques
Authors: Guan-Long Wu | Huitao Yu | Ze-Tao Xiao | Haiming Shi | Yuan Hu | Zhou Gui | Xin Wang
Source: Composites Part A Applied Science and Manufacturing (article, 2025-10-25)
Field: Materials Science — Materials Chemistry

Synergistic effects of boron nitride sheets and nanowires on improving the thermal conductivity, dielectric properties, mechanical strength, and fire safety of multifunctional epoxy composites Boron nitride ; Epoxy ; Dielectric ; Ultimate tensile strength ; Dielectric loss ; Nanowire ; Compounding ; Nanocomposite Thermal properties of materials ; Flame retardant materials and properties ; Mechanical Behavior of Composites
Authors: Bakr Ahmed Taha | S.A. Abdulateef | Ali J. Addie | Suha A. Muneam | Nada. A. Muneam | Adawiya J. Haider | Naser M. Ahmed | Vishal Chaudhary | Norhana Arsad
Source: Materials Research Bulletin (article, 2025-04-26)
Field: Materials Science — Materials Chemistry

Paradigm of nanophotonics integrated smart contact lenses: A new frontier in wearable healthcare Nanophotonics ; Frontier ; Wearable computer ; Nanotechnology ; Wearable technology ; Health care ; Healthcare system ; Computer science ; Materials science ; Human–computer interaction ; Political science ; Embedded system Quantum Dots Synthesis And Properties ; Ocular Surface and Contact Lens ; Optical Wireless Communication Technologies
Authors: Guoqing Gou | Zexin Li | Xiang Xu | Haoyun Wang | Honggang Gu | Liang Gao | Tianyou Zhai | Xing Zhou
Source: Small (review, 2025-07-11)
Field: Materials Science — Materials Chemistry

Broadband Visual Information Processing with 2D Materials Broadband in-sensor computing (BISC) technology integrates high-dimensional visual perception and processing, significantly reducing inter-unit data exchange while enhancing system efficiency and response speed. This capability is particularly crucial in addressing the exponential growth of broadband visual sensing data driven by the rapid advancement of machine vision. 2D materials, with strong light-matter interactions, broadband absorption, tunable electronic structures, and exceptional integration compatibility, offer a compelling platform for monolithic BISC implementation. This review systematically explores recent progress in broadband visual information perception and processing based on 2D materials. It begins by categorizing the broadband photodetection potential of various 2D materials, followed by an in-depth discussion of their integration into photodetectors, focusing on intrinsic 2D materials, localized field enhancement, and heterostructures. The latest advancements in BISC are then highlighted, emphasizing emerging strategies for high-dimensional visual information processing. Finally, key challenges and future directions are discussed, aiming to guide the development of 2D materials toward integrated high-dimensional sensing and intelligent computing. Photodetection ; Broadband ; Computer science ; Perception ; Photodetector ; Telecommunications ; Materials science ; Optoelectronics 2D Materials and Applications ; Gas Sensing Nanomaterials and Sensors ; Ga2O3 and related materials
Authors: Sarmistha Saha
Source: Frontiers in Nanotechnology (article, 2025-03-05)
Field: Materials Science — Materials Chemistry

How nanoinformatics could pave the way to safer design of engineered nanomaterials? Applications of nanotechnology have rapidly expanded across various fields, including materials, energy, medicine, and the environment. The toxicity of nanomaterials (NMs) and nanotechnology to living organisms, as well as potential negative environmental impacts, poses significant challenges. Laboratory approaches for assessing the negative impacts of NMs are costly, time-consuming, and frequently fall behind the development of novel materials. Therefore, intelligent systems of informatics to forecast their toxicity potentials are a possible alternative option. Research on nanotoxicology has generated extensive and diverse datasets. However, data alone does not equate to information. Since little is known about how to extract meaningful information from large streams of data, a broad discussion of potential concerns still exists. In this regard, we present a perspective on how the “big data” can change the paradigm toward data-centric computational materials research to decipher the toxicity mechanisms of NMs for their efficient risk assessment management to provide safe-by-design standards for the sustainable advancement of nanotechnology. We will also discuss the challenges of the current data-driven research into the nano realm. SAFER ; Nanotechnology ; Risk analysis (engineering) ; Computer science ; Business ; Materials science ; Computer security Nanoparticles: synthesis and applications ; Nanotechnology research and applications ; Machine Learning in Materials Science
Authors: Luca Gritti | Denny Coffetti | Marina Cabrini | Tommaso Pastore
Source: International Journal of Hydrogen Energy (article, 2025-03-01)
Field: Materials Science — Materials Chemistry

A novel approach for estimating hydrogen uptake and diffusion coefficient Hydrogen diffusional parameters in metallic alloys were evaluated for API 5L-grade X65 steel by introducing a simplified approach using a single-compartment electrochemical cell. The experimental hydrogen flow from electrochemically pre-charged specimens is interpolated through a numerical approach, with a simulated target curve derived for a specific geometry. The diffusion coefficient and concentration of diffusible hydrogen were estimated after hydrogen charging in alkaline solutions at different levels of cathodic polarisation. The results show constant and reproducible values of diffusivity despite the level of polarisation, and the concentration of diffusible hydrogen increases with cathodic overpotential, depending on the composition of the solution. • Mono-electrochemical cell is used to determine hydrogen diffusional parameters. • Data-driven optimisation of hydrogen 3D-flow on electrochemically charged specimens. • Diffusion coefficient and hydrogen concentration estimated after alkaline charging. • Constant, reproducible apparent diffusion coefficients of hydrogen were obtained. • Hydrogen concentration increases with cathodic overpotential, based on solution. Diffusion ; Hydrogen ; Effective diffusion coefficient ; Thermodynamics ; Materials science ; Chemistry ; Physics ; Medicine Nuclear Materials and Properties ; Hydrogen embrittlement and corrosion behaviors in metals ; Radioactive element chemistry and processing
Authors: Jack L. Bennett | Tarick J. El‐Baba | Konstantin Zouboulis | Carla Kirschbaum | Haigang Song | Frances I Butroid | Justin L. P. Benesch | Corinne A. Lutomski | Carol V. Robinson
Source: Nature Methods (article, 2025-09-29)
Field: Chemistry — Spectroscopy

Uncovering hidden protein modifications with native top-down mass spectrometry Protein modifications drive dynamic cellular processes by modulating biomolecular interactions, yet capturing these modifications within their native structural context remains a significant challenge. Native top-down mass spectrometry promises to preserve the critical link between modifications and interactions. However, current methods often fail to detect uncharacterized or low-abundance modifications, limiting insights into proteoform diversity. To address this gap, we introduce precise and accurate Identification Of Native proteoforms (precisION), an interactive end-to-end software package that leverages a robust, data-driven fragment-level open search to detect, localize and quantify 'hidden' modifications within intact protein complexes. Applying precisION to four therapeutically relevant targets-PDE6, ACE2, osteopontin (SPP1) and a GABA transporter (GAT1)-we discover undocumented phosphorylation, glycosylation and lipidation, and resolve previously uninterpretable density in an electron cryo-microscopy map of GAT1. As an open-source software package, precisION offers an intuitive means for interpreting complex protein fragmentation data. This tool will empower the community to unlock the potential of native top-down mass spectrometry, advancing integrative structural biology, molecular pathology and drug development. Limiting ; Context (archaeology) ; Identification (biology) ; Drug discovery ; Protein–protein interaction ; Mass spectrometry ; Software ; Fragmentation (computing) ; Proteomics Mass Spectrometry Techniques and Applications ; Advanced Proteomics Techniques and Applications ; Enzyme Structure and Function
Authors: Zhiwei Gao | D. W. Shi | Jiawei Xu | Te Hai | Yao Zhao | Meng Qin | Jian Li
Source: Nanomaterials (review, 2025-07-04)
Field: Materials Science — Materials Chemistry

Vanadium-Based MXenes: Types, Synthesis, and Recent Advances in Supercapacitor Applications Since the discovery of two-dimensional transition metal carbides and nitrides (MXenes), MXenes have attracted widespread research in the academic community due to their advantages, such as adjustable interlayer spacing, excellent hydrophilicity, conductivity, compositional diversity, and rich surface chemical composition. More than 100 different MXene combinations can be calculated theoretically, but only more than 40 have been successfully synthesized through experiments. Among the many synthesized and reported MXene materials, vanadium-based carbide MXenes, represented by V<sub>2</sub>CT<i><sub>x</sub></i> and V<sub>4</sub>C<sub>3</sub>T<i><sub>x</sub></i>, show excellent application prospects in energy storage and have become the focus of researchers. In this review, we mainly discuss the structure, characteristics, and preparation methods of vanadium-based MXene precursors in the MAX phase and their applications in supercapacitors. Finally, we propose the main challenges existing at the current stage of vanadium-based materials and their heterostructures and provide a perspective on future research directions. MXenes ; Supercapacitor ; Materials science ; Vanadium ; Vanadium carbide ; Nanotechnology ; Carbide ; Vanadium nitride ; Titanium carbide ; Nitride ; Engineering physics ; Chemistry ; Layer (electronics) ; Metallurgy ; Physics ; Electrochemistry ; Electrode ; Physical chemistry MXene and MAX Phase Materials ; Supercapacitor Materials and Fabrication ; Advancements in Battery Materials
Authors: Loukia Plakia | Ioannis Α. Kartsonakis
Source: Energies (review, 2025-07-01)
Field: Materials Science — Electronic, Optical and Magnetic Materials

A Review on Design, Synthesis and Application of Composite Materials Based on MnO2 for Energy Storage The design, synthesis, and application of composite materials based on manganese dioxide (MnO2) for energy storage are pivotal in advancing efficient, sustainable, and high-performance energy storage systems. The MnO2 is widely recognized for its abundance, low cost, environmental friendliness, and excellent electrochemical properties, making it a promising candidate for use in supercapacitors, batteries, fuel cells, and other energy storage systems. This study offers a comprehensive overview of how various materials influence the performance of MnO2 as an energy storage medium. Specifically, the design of composite materials is examined with respect to morphological control, integration with conductive additives, doping strategies, and structural engineering, all of which impact the final material properties. Additionally, the influence of diverse synthetic techniques—including hydrothermal synthesis, electrochemical deposition, sol–gel processing, co-precipitation, and templating methods—is evaluated. The latest attempts through which the developed composites showcase improved structural stability, inherent conductivity, and electron mobility compared to the original first material are presented in this review article. The presented results have been quite promising for the synthesis of great-performing materials with improved electrochemical data compared to that of MnO2 alone, competing with other significant energy storage materials. This review highlights future prospects for the development of state-of-the-art devices, large-scale production applications, and the use of environmentally friendly materials and methods. It is anticipated that this research will provide valuable insights to facilitate further improvements in performance and broaden the scope of practical applications in this rapidly evolving field of composite materials. Composite number ; Energy storage ; Materials science ; Process engineering ; Engineering ; Composite material ; Physics ; Thermodynamics Supercapacitor Materials and Fabrication ; Advanced battery technologies research ; Advanced Battery Technologies Research
Authors: Evgeniy S. Seliverstov | M. N. Yapryntsev | E. A. Tarasenko | О. Е. Лебедева
Source: RSC Mechanochemistry (article, 2025-01-01)
Field: Materials Science — Materials Chemistry

Increasing the number of cations in layered double hydroxides <i>via</i> mechanochemically complemented synthesis: the more the merrier, or not? A series of layered double hydroxides Mg/Al, MgNi/Al, MgNi/AlIn, MgNiCo/AlIn, MgNiCo/AlInSc, and MgNiCo/AlInScTm were obtained, and their properties were evaluated. Layered double hydroxides ; Hydrothermal circulation ; Hydrothermal synthesis ; Materials science ; Crystallization ; Chemical engineering ; Catalysis ; Chemistry ; Organic chemistry ; Engineering Layered Double Hydroxides Synthesis and Applications ; Magnesium Oxide Properties and Applications ; Ferroelectric and Piezoelectric Materials
Authors: Jiaming Li | Xu Cheng | Chunhui Du | Wanyi Zhang | Sheng Li | Wenyuan Xu | Hui Shi | Ge Zhang | Xubiao Luo
Source: Nanoscale (article, 2025-01-01)
Field: Materials Science — Polymers and Plastics

P(TT-TPA) featuring a conjugated extended structure: enabling high-performance flexible electrochromic-supercapacitors Electrochromic-supercapacitors (EC-SCs) based on conducting polymers hold broad application prospects in fields such as smart electronic devices, wearable devices, and the Internet of Things. However, complex structures generated by their large molecular weights severely deteriorate the disorder of chain arrangements, which significantly hinders the migration of charge carriers within the chains and exerts an adverse impact on the opto/electric performance. In this work, triphenylamine (TPA) is adopted as the scaffold, and thieno[3,2-<i>b</i>]thiophene (TT) groups are introduced to successfully construct TT-TPA (HTPA) with a conjugated extended structure. Leveraging the intermolecular π-π stacking effect effectively restricted the rotation of single bonds, significantly enhancing the molecular planarity. Concurrently, the introduction of multiple active sites opened up more channels for charge storage. The obtained P(TT-TPA) (PHTPA) films exhibit remarkable optical contrast (51% at 1050 nm) and outstanding energy storage capacity (177 F g<sup>-1</sup> at 1 A g<sup>-1</sup>). The flexible devices based on PHTPA show significant color changes, excellent capacitive performance (46 F g<sup>-1</sup> at 1 A g<sup>-1</sup>), and good bending resistance. In summary, the molecular design strategy of expanding the conjugated structure furnishes a certain theoretical foundation and referential significance for the development of EC-SC electrode materials that balance comprehensive performances. Electrochromism ; Supercapacitor ; Conjugated system ; Materials science ; Nanotechnology ; Electrochromic devices ; Electrochemistry ; Chemistry ; Polymer ; Electrode ; Composite material Conducting polymers and applications ; Transition Metal Oxide Nanomaterials ; Supercapacitor Materials and Fabrication
Authors: Sanja Kuzman | Tatjana Dramićanin | Anatoli I. Popov | M.G. Brik | Miroslav D. Dramićanin
Source: Nanomaterials (review, 2025-02-11)
Field: Materials Science — Materials Chemistry

Pigments and Near-Infrared Phosphors Based on Mn5+ The optical properties of Mn<sup>5+</sup> ions, which are responsible for the intense green-turquoise-blue coloration of Mn<sup>5+</sup>-based pigments and the near-infrared emission of phosphors, are the focus of this article. Mn<sup>5+</sup> ions enter crystalline matrices in four-fold coordinated positions and can maintain their 5+ valence state when crystalline hosts meet the conditions described in this work. Mn<sup>5+</sup> ions have [Ar]3d<sup>2</sup> electronic configuration and always experience a strong crystal field due to a high electric charge; therefore, their lower electronic states have the <sup>3</sup>A<sub>2</sub> < <sup>1</sup>E < <sup>1</sup>A<sub>1</sub> < <sup>3</sup>T<sub>2</sub> < <sup>3</sup>T<sub>1</sub> progression in energy. We present the properties of several Mn<sup>5+</sup>-based pigments and discuss the electronic transitions responsible for their coloration. Specifically, we show that the color is determined by the spin-allowed <sup>3</sup>A<sub>2</sub> → <sup>3</sup>T<sub>1</sub>(<sup>3</sup>F) absorption, which extends across the orange-red-deep red spectral region and is strongly influenced by crystal field strength. The narrow-band emission Mn<sup>5+</sup>-activated near-infrared phosphors arise from the spin-forbidden <sup>1</sup>E → <sup>3</sup>A<sub>2</sub> transition, whose energy is independent of the crystal field strength and determined by the nephelauxetic effect. We demonstrate the linear relationship between <sup>1</sup>E state energy and the nephelauxetic parameter <i>β</i><sub>1</sub> using Racah parameter literature data for Mn<sup>5+</sup> phosphors. Lastly, we address the recent applications of these Mn<sup>5+</sup> phosphors in luminescence thermometry. Phosphor ; Infrared ; Pigment ; Materials science ; Computer science ; Chemistry ; Optics ; Optoelectronics ; Physics ; Organic chemistry Luminescence Properties of Advanced Materials ; Pigment Synthesis and Properties ; Transition Metal Oxide Nanomaterials