Search
1969 articles for “quantum mechanics/molecular mechanics (QM/MM)” (ranking capped at the first 2,000 matches — narrow the search to see the rest)
Nothing matched all of your words, so these match any of them.
-
Self-Healing Polymeric Composites Reinforced with Green Synthesized Nanoparticles
Abstract: The development of sustainable self-healing polymeric materials is critical for enhancing durability and service life in advanced engineering applications. In this study, zinc oxide (ZnO), magnesium oxide (MgO), and ferric oxide (Fe₂O₃) nanoparticles were green-synthesized using Allium cepa extract and incorporated into epoxy-based polymeric composites to improve mechanical, thermal, and self-healing properties. This bio-based synthesis is eco-friendly and safe alternative to harsh chemical techniques, utilizing natural antioxidants to stabilize the …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 305–314 Read article
-
Collaborative Robotics and Smart Automation: Enhancing Human–Robot Synergy in Industry 5.0
Abstract: Industry 5.0 marks a paradigm shift from efficiency-centric automation to a human-centred, sustainable, and collaborative production environment . In this context, collaborative robots, commonly referred to as cobots, play a central role by enabling direct and safe interaction between humans and machines within shared workspaces. These systems are designed to support human operators by undertaking repetitive, precision-intensive, and physically demanding tasks, thereby allowing humans to focus on supervisory control, problem-solving, …
Published in International Journal of Advanced Robotics and Automation Technology · Vol. 4, Issue 1, 2026 · pp. 22–29 Read article
-
Regional Variation in Amino Acid Composition, Antioxidant and Antimicrobial Activity of Tasar Sericin from North and South Bihar
Abstract: This study investigates geographical differences in biochemical and functional characteristics of sericin obtained from Antheraea mylitta cocoons sourced from two regions of Bihar, India: Bhagalpur (North) and Banka (South). Sericin was isolated via an alkali-assisted autoclaving process. Amino acid profiles were determined using HPLC. Free radical scavenging capacity was measured through DPPH, ABTS, and hydrogen peroxide assays. Antibacterial and antifungal effects were tested against Staphylococcus aureus, Escherichia coli, and Candida …
Published in Research and Reviews : A Journal of Life Sciences · Vol. 16, Issue 2, 2026 Read article
-
Data-Driven Digital Twin Model for Real-Time Strength Estimation in Polymeric Materials
Abstract: The real-time prediction of mechanical properties in polymeric materials is essential for ensuring quality, consistency, and operational efficiency in modern manufacturing systems. As industrial processes become increasingly complex, traditional trial-and-error approaches to material characterization are no longer sufficient to meet the demands of high-throughput production environments. This study introduces a digital twin-integrated machine learning approach for the real-time estimation of tensile strength in polymeric materials by combining simulation-driven insights with …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 246–257 Read article
-
Circadian Regulation of Lipid Peroxidation in the Brain: Linking Ferroptosis to Neurodegenerative Vulnerability
Abstract: The human brain operates through highly coordinated physiological and biochemical processes that regulate cognition, behavior, and neural adaptability. Central to these processes are mechanisms governing brain function, neurophysiology, and neuroplasticity, which are increasingly recognized to be influenced by circadian rhythms. Recent advances in cognitive neuroscience, neuroimaging, and behavioral neuroscience have revealed that disruptions in circadian regulation can significantly impact oxidative balance within the brain, particularly through enhanced lipid peroxidation. Lipid …
Published in International Journal of Brain Sciences · Vol. 3, Issue 2, 2026 · pp. 1–14 Read article
-
Biopolymer-Based 3D Composite Scaffolds for Bone Tissue Engineering: Photothermal-Responsive Systems with Controlled Pt (IV) Prodrug Release
Abstract: Biopolymer-based composite scaffolds have attracted significant attention as multifunctional platforms at the intersection of polymer science, regenerative medicine, and cancer nanotherapy. In this study, a dual-functional scaffold was developed for simultaneous osteosarcoma treatment and bone regeneration using poly (L-lactic acid) (PLLA) reinforced with bioactive glass (BG) and integrated with a glutathione-responsive platinum (IV) prodrug system (PDA@Pt). To improve interfacial adhesion, photothermal conversion efficiency, and tumor-specific activation, the Pt (IV) prodrug …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 351–361 Read article
-
Differential Gene Expression Analysis of Human Atrial Fibroblasts Reveals Dysregulation of RNA Metabolism and Translational Machinery in Atrial Fibrillation
Abstract: Atrial fibrillation (AF) is a complex cardiac arrhythmia characterized by extensive structural remodeling and the activation of atrial fibroblasts, which drive the progression of fibrosis. To identify the underlying transcriptomic alterations, we analyzed six human atrial fibroblast RNA-Seq datasets (three control and three AF) retrieved from the Sequence Read Archive. After performing rigorous quality control and adapter trimming, we aligned the reads to the GRCh38 human reference genome using a …
Published in International Journal of Bioinformatics and Computational Biology · Vol. 4, Issue 2, 2026 · pp. 15–25 Read article
-
Dynamic Vibration and Damping Analysis of Sustainable Nano-Reinforced Polymer Composite Elements for Vehicle Suspension Applications
Abstract: This paper presents an analytical investigation into the dynamic vibration characteristics of nano-reinforced polymer composite elements intended for vehicle suspension applications. A single-degree-of-freedom (SDOF) quarter-car model is employed to derive fundamental expressions for natural frequency, damping ratio, logarithmic decrement, and displacement transmissibility. The primary contribution lies in establishing explicit analytical linkages between material-level viscoelastic properties specifically storage modulus and loss modulus and system-level suspension parameters including stiffness and damping coefficients. …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 561–570 Read article
-
pH-Responsive Smart Polymer Nanocomposites for Anti-Corrosive Coatings
Abstract: Metallic corrosion under adverse marine and industrial conditions imposes gigantic financial burdens and risks worldwide. Conventional waterproofing waterborne epoxy has passive barrier protection, but is also inherently microporous, lacking intrinsic repair ability against mechanical damage and thus rapidly decays. This is a critical gap that this work tries to bridge by designing a new pH-responsive hybrid polymer nanocomposite by using polyethyleneimine-tannic acid-cerium functionalized boron nitrate nanosheets with chitosan-capped mesoporous silica …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 201–213 Read article
-
Recycling and Reinforcement of Retired EV Battery Materials in Polymer Composites for Sustainable Engineering Applications
Abstract: The rapid proliferation of electric vehicles (EVs) has led to a substantial increase in lithium-ion battery waste, necessitating sustainable strategies for material recovery and reuse. This review explores the valorization of retired Electrical Vehicle batteries within polymer and composite systems, highlighting second-life applications as a promising pathway toward circular material utilization. Batteries retaining 70–80% of their original capacity remain suitable for extended use; however, beyond conventional energy storage, their constituent …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 362–371 Read article
-
Synthesis of Zinc Oxide Nanoparticles Through Polymeric Precursor Route and their Integration into Functional Nanocomposites
Abstract: A polymer precursor approach for creating zinc oxide (ZnO) nanoparticles with regulated size and shape is described in this work. By stabilising and capping particles, the polymer-assisted pathway efficiently reduces particle agglomeration while facilitating controlled nucleation and growth. The surface shape and dispersion of the produced ZnO nanoparticles were assessed using the scanning electron microscopy (SEM). When compared to traditional synthesis techniques, the addition of polymer greatly enhanced surface homogeneity …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 883–890 Read article
-
Development and implementation of Solar-Thermoelectric Hybrid Energy Harvester
Abstract: In today’s consumer-oriented and technology-driven market, researchers are increasingly emphasizing the need to harvest energy from ambient and renewable sources to support sustainable power generation and to minimize dependence on conventional energy resources such as batteries and fossil-fuel-based electricity. The rising deployment of portable electronics, wireless sensor networks, and Internet of Things (IoT) devices has created an urgent demand for compact, low-power, long-life, and maintenance-free energy solutions. In many real-world …
Published in International Journal of Machine Systems and Manufacturing Technology · Vol. 4, Issue 1, 2026 Read article
-
High-Performance Polymer Composite Membranes for Selective Ion Transport in Advanced Energy Conversion Systems
Abstract: The development of high-performance Polymer Composite Membranes (PCM) with enhanced ion transport is essential for Polymer Electrolyte Membrane Fuel Cells (PEMFC). However, low-humidity conditions and filter agglomeration still limit long-term membrane stability. This research designs a functionalized PCM integrating cross-linked Poly (Vinyl Alcohol)/Poly (Ethylene Glycol) (PVA/PEG) matrix with sulfonic acid functional groups and Titanium Dioxide (TiO₂) nanofillers to improve selective ion transport under low-humidity conditions. Two types of PCM were …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 724–736 Read article
-
Wear and Tribological Characteristics of Novel Metal Matrix Composites
Abstract: The development of advanced metal matrix composites (MMCs) with enhanced tribological performance has become increasingly important due to the premature failure of critical engineering components operating under severe wear conditions in automotive, aerospace, marine, defense, and power generation systems. Conventional composites such as Copper–Alumina and Aluminium–Silicon Carbide have demonstrated improved mechanical and wear characteristics; however, their widespread application is often limited by issues including particle agglomeration, non-uniform reinforcement distribution, porosity …
Published in Journal of Polymer & Composites · Vol. 14, Issue 2, 2026 · pp. 1326–1346 Read article
-
Design and Development of a Low-Cost Quadruped Robot for Educational Robotics Applications
Abstract: The locomotion of the quadruped robots resembles that of four-legged animals and can be used on surfaces that wheeled robots cannot navigate. The paper is a design and development report on a low-cost quadruped robot that has been designed to be used in educational and experimental robotics. The robot is a lightweight and modular robotic system consisting of a combination of mechanical design, embedded control, and wireless communication. The actuation …
Published in International Journal of Manufacturing and Production Engineering · Vol. 4, Issue 1, 2026 · pp. 20–26 Read article
-
Polymer Composite-Enabled UAV Platform for Edge AI-Based Precision Agriculture: A System-Level Evaluation
Abstract: This study investigates the system-level role of commercially available polymer composite materials in enabling lightweight and energy-efficient unmanned aerial vehicle (UAV) platforms integrated with edge artificial intelligence for real-time agricultural monitoring. Rather than developing or experimentally characterizing new composite materials, the work evaluates fiber-reinforced polymer (FRP) composites and epoxy-based laminates as enabling structural components whose established properties support UAV performance in precision agriculture. Their high strength-to-weight ratio, corrosion resistance, and …
Published in Journal of Polymer & Composites · Vol. 14, Issue 4, 2026 · pp. 218–240 Read article
-
Medicinal Properties of Oxytenanthera abyssinica: A Narrative Review
Abstract: Oxytenanthera abyssinica, a plant local to the African landmass, has gotten a parcel of intrigued in later a long time for its conceivable restorative benefits; it has been utilized in conventional medication for decades since of its assumed mending capabilities. In spite of its long history, careful logical examination into its restorative potential is being attempted. This review paper explore into the multidimensional part of O. Abyssinica is in progressed …
Published in Research & Reviews: A Journal of Pharmacognosy · Vol. 13, Issue 2, 2026 Read article
-
Effect of machining parameters on the tool wear in drilling of 3D PF C/C composite
Abstract: Carbon–carbon (C/C) composites are broadly used in aerospace, defence, shipbuilding, chemical, and nuclear industries owing to their high strength-to-weight and stiffness-to-weight ratios. However, they are brittle, anisotropic and non-homogeneous in nature, making them difficult to machine. Incorrect machining parameters can cause defects such as burrs, delamination, and fibre bundles pullout. This paper aims to study the hole surface and tool wear during drilling of 3D pierced fabric (PF) carbon-carbon (C/C) …
Published in Journal of Polymer & Composites · Vol. 14, Issue 4, 2026 · pp. 269–281 Read article
-
Machine Learning Based Optimization of Polymer Structure Property Relationships in Composite Material Systems
Abstract: In modern engineering applications, polymer-based composite materials have garnered a lot of attention because of their lightweight nature, high strength-to-weight ratio, and changing physical features. In order to maximize the relationships between polymer structure and properties in composite materials, this study suggests a strategy based on reinforcement learning (RL). The research utilized the Polymer Composite Properties Dataset, which contains 12,700 records associated with polymer matrices, reinforcement fillers, interfacial bonding characteristics, …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 242–255 Read article
-
Linear Stability in the Restricted Three-Body Problem with Oblate Primaries
Abstract: We present a study of the linear stability which is based on numerically we find that the critical mass ratio of the primaries forms a smooth surface and absence that c decrease as oblate parameter increase. In the restricted three-body problem the collinear points are unstable and equilateral triangular points are stable for the mass ratio . The numerical calculations give a thorough explanation of how changes in …
Published in Research & Reviews : Journal of Space Science & Technology · Vol. 15, Issue 2, 2026 Read article