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.
-
Investigation of microstructure and mechanical properties of multi-pass friction stir processing on precipitation hardened aluminum alloy
Abstract: In the present study, multi-pass friction stir processing of aluminum AA2014-T651 alloy is per-formed with one and four passes. The multi-pass processing is performed at a tool rotational speed of 1000 rpm with a traverse speed of 63 mm/min. Microstructural characterization of fric-tion stir processed specimens indicated a significant grain refinement with equiaxed grains in the four pass specimen. Microhardness and tensile strength of the multi-pass specimen decreases with the …
Published in Journal of Polymer & Composites · Vol. 12, Issue 1, 2024 · pp. 339–349 Read article
-
A Novel Approach for Power Generation from Ocean Waves Using Ratchet and Pawl Mechanism
Abstract: Renewable energy sources collectively contribute around 29% to 30% of global electricity generation. Solar and wind power’s intermittency and weather dependency pose challenges for unreliable energy generation, requiring storage solutions like batteries and environmental considerations. By considering the above-mentioned factors, ocean wave energy stands out as a promising and consistent renewable source. Ocean wave energy is highly predictable and consistent, offering a dependable power supply with minimal greenhouse gas emissions …
Published in Recent Trends in Fluid Mechanics · Vol. 11, Issue 1, 2024 · pp. 1–7 Read article
-
ISGylation: A Key Host Cellular Defense Mechanism
Abstract: ISGylation, a crucial process of the innate immune response, has garnered increasing attention for its involvement in host's defense against pathogenic infections as well in cancer progression. The key player of ISGylation, ISG15, is stimulated by type I interferons (IFNs). ISG15 covalently binds with viral (influenza NS1A and nucleoproteins) and host (Nedd4, filamin B and CHMP5) target proteins and this interaction inhibits the viral replication process and release of viral …
Published in Research and Reviews : A Journal of Life Sciences · Vol. 14, Issue 2, 2024 · pp. 68–80 Read article
-
Advancements in Windmill Technology: Comprehensive Research on Conventional and Piezoelectric Windmills
Abstract: This research delves into the structural components and mechanisms of conventional wind turbines, emphasizing blade material considerations for optimal performance. It introduces a paradigm shift by exploring the use of epoxy resin and piezoelectric materials, specifically zinc oxide, in wind turbine blades. The study presents mathematical models and conducts a comparative analysis between conventional and piezoelectric turbines, evaluating efficiency, cost-effectiveness, environmental impact, and energy output differences. While awaiting experimental data, …
Published in Journal of Aerospace Engineering & Technology · Vol. 14, Issue 3, 2024 · pp. 31–42 Read article
-
Mechanical Properties of Rice Husk Ash Based Concrete Composites
Abstract: The production of rice is important all over the world. The husk that is made is usually used as a combustible material to prepare fields, giving energy through both direct combustion and gasification. The material rice husk ash may be quite fine. A common particle size for rice husk ash is 3 to 75 µm. This research demonstrates how the rice husk ash affects the mechanical properties of concrete composites. …
Published in Journal of Polymer & Composites · Vol. 12, Issue 7, 2024 · pp. 67–72 Read article
-
Fabrication and Experimental Investigation on Mechanical Properties of Quartz Particulate Reinforced Aluminium Composite
Abstract: Composites are processed by adding a reinforcement phase in a base metal. The base material is known as a matrix and the constituent that is added is called reinforcement. The matrix acts as a support while the reinforcements attach themselves in their respective positions which results in the synthesis of a material which has different mechanical and thermal properties compared to their raw materials. Since aluminium is used as a …
Published in Journal of Production Research & Management · Vol. 14, Issue 3, 2024 Read article
-
Microstructural Characterisation and Analysis of Mechanical Behaviour of Hybrid AA 7075/7178 Fabricated Using Die Casting Technique
Abstract: AA are being increasingly used in the field of structural engineering owing to their desirable mechanical properties coupled with their recyclable and sustainable nature, thus contributing significantly towards reduction of carbon footprints and development of circular economy. Till date numerous research projects have been prompted to investigate the structural performance of aluminium alloy structures and develop alternatives with enhanced performance parameters. AA 7xxx (Al-Zn-Mg-Cu) are being widely used in variety …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 441–451 Read article
-
Examining the Role of Synthetic Biology in Cellular Restoration Mechanisms
Abstract: Synthetic biology has emerged as a transformative field with the potential to revolutionize cellular repair mechanisms, offering innovative solutions to repair damaged DNA, stabilize proteins, regenerate tissues, and treat a wide range of diseases. By combining principles from genetic engineering, biotechnology, and computational biology, synthetic biology enables the design of cellular systems capable of performing functions that repair cellular damage and restore normal cellular processes. This article explores the application …
Published in International Journal of Cell Biology and Cellular Functions · Vol. 2, Issue 2, 2024 · pp. 19–29 Read article
-
Homeopathy: A Comprehensive Review of Efficacy, Mechanisms, and Controversies
Abstract: Homeopathy is a widely used alternative medical system based on principles established by Samuel Hahnemann, including “like cures like” and potentization Despite its popularity, homeopathy remains controversial due to the highly diluted nature of its remedies, which often contain no detectable molecules of the original substance. This article provides a comprehensive review of the clinical efficacy, proposed mechanisms, and ongoing controversies surrounding homeopathy Clinical studies yield mixed results, with some …
Published in Research & Reviews : A Journal of Unani, Siddha and Homeopathy · Vol. 12, Issue 1, 2025 · pp. 25–32 Read article
-
Nutraceuticals as Adjunctive Treatment in Cancer Exploring Efficacy and Mechanism of Action
Abstract: Dietary habits are a critical factor in cancer prevention, with plant-based diets rich in vegetables and fruits associated with reduced cancer risk. Nutraceuticals—bioactive compounds derived from food and supplements—have gained attention for their potential in cancer prevention and therapy. Phytochemicals such as flavonoids, polyphenols, and alkaloids exhibit anti-cancer properties through mechanisms including antioxidant activity, anti-inflammatory effects, inhibition of tumor growth, and induction of apoptosis. Key nutraceuticals include alkaloids (e.g., caffeine, …
Published in Research & Reviews: A Journal of Pharmacognosy · Vol. 12, Issue 1, 2025 · pp. 35–45 Read article
-
Effect of Carbon Nanotube on Mechanical Properties of Jute Fibre Reinforced Polyester Composite
Abstract: The current study studies how carbon nanotubes affect the mechanical characteristics of polyester composites reinforced with jute fiber, both treated and unprocessed. Alkali was used to cure jute textiles. Composites with treated and untreated jute fibre with 5%, 10% and 15% jute fibre loading with and without carbon nanotube were prepared using hand lay-up process. Carbon nanotubes varied from 0.2%, 0.4% and 0.6%. Tensile, flexural, and strength of impact all …
Published in International Journal of Fracture Mechanics and Damage Science · Vol. 2, Issue 2, 2024 · pp. 1–9 Read article
-
Tobacco and COVID-19: Molecular Interactions and Public Health Challenges – A Review
Abstract: Tobacco use exacerbates health risks, making it a significant concern during the COVID-19 pandemic. Smoking has been implicated in the upregulation of ACE2 receptors, critical for SARS- CoV-2 entry, and contributes to immune dysregulation and oxidative stress, worsening clinical outcomes. Methods: This review synthesizes evidence on the molecular mechanisms linking tobacco and COVID-19, assesses risk factors, such as smoking status and comorbidities, and explores public health challenges in managing the …
Published in International Journal of Virus Studies · Vol. 2, Issue 1, 2025 · pp. 1–6 Read article
-
Virulence Factors in pathogens :mechanisms of infection & disease progression
Abstract: Pathogens, like bacteria, viruses, fungi, and parasites, have evolved specialized tools – known as virulence factors – that help them infect hosts, escape the immune system, and cause disease. These factors play a key role in determining how severe an infection becomes, how quickly it spreads, and how the body responds. Some pathogens use adhesins to stick to host cells, while others produce toxins that damage tissues or disrupt normal …
Published in International Journal of Pathogens · Vol. 2, Issue 1, 2025 · pp. 6–11 Read article
-
Biochar-Filled Soy Protein Composites: Evaluating Thermal and Mechanical Properties for Sustainable Polymer Applications
Abstract: The growing demand for environmentally sustainable and biodegradable materials has intensified interest in alternative solutions for thermal insulation. This study explores the development of composite materials using mango seed shell biochar (MSSB) and soy protein isolate (SPI) as a biodegradable matrix-filler system. Mango seed shells, an abundant agro-industrial waste, were subjected to pyrolysis at 500°C for 2 hours to produce biochar. The resulting MSSB was incorporated into SPI with glycerol …
Published in Journal of Polymer & Composites · Vol. 13, Issue 3, 2025 · pp. 60–71 Read article
-
Enhancing Concrete Durability and Mechanical Properties for Pavement Quality Concrete (PQC) Roads Using Basalt Fiber Reinforcement
Abstract: Concrete, by nature, is brittle and has a very low tensile capacity, which is a double whammy in transportation infrastructure, such as pavement quality concrete (PQC), for roadways, where we need durability and strength. One such method is the use of basalt fibre, as it is a much better way of enhancing the road runway way performance of concrete. This research studies the impact of the addition of basalt fibres …
Published in Journal of Polymer & Composites · Vol. 13, Issue 4, 2025 · pp. 266–280 Read article
-
Exploring the Mechanical Characterization and Microstructural Properties of the Varying Weight % of Nano Boron Carbide (nB4C) Reinforced Al2024 composites using the Vacuum-Assisted Stir Casting Method
Abstract: In this investigation the stir casting technique is utilized to fabricate Al2024-B4C nano composites. The nanoB4C particles used in the reinforcement material have a particle size of 50 nm and variable weight percentages. In Al2024 composites, boron carbide reinforcement is included at weight percentages ranging from 0% to 3%, with a 1% interval between each percentage addition. Following the casting process, the samples were prepared for microstructural and mechanical evaluation …
Published in Journal of Polymer & Composites · Vol. 13, Issue 5, 2025 · pp. 394–404 Read article
-
Study of the Rheological, Physical-Mechanical Properties of Disposed Polypropylene and Polyvinyl Chloride Binary Mixtures
Abstract: In this study, various compositions were prepared by modifying the decommissioned polypropylene (PP)-based polymer waste with polyvinyl chloride (PVC) in different proportions for the purpose of modification, and the flow index and physical and mechanical properties of their alloys were studied. As a result of the research, the following results were obtained. PP/PVC binary compositions were prepared and samples were obtained based on 6 different proportions by changing the amount …
Published in Journal of Polymer & Composites · Vol. 13, Issue 6, 2025 Read article
-
Enhancing Mechanical and Durability Properties of Coconut Shell Concrete Using Fly Ash
Abstract: The increasing demand for sustainable and lightweight construction materials has driven research into alternative aggregates for concrete production. This study investigates the mechanical and durability properties of coconut shell (CS) concrete with varying percentages of fly ash replacement. The research evaluates compressive strength, split tensile strength, water absorption, and workability to determine the feasibility of CS concrete as a structural material. Experimental findings indicate that incorporating 10% fly ash (CSF10 …
Published in Recent Trends in Civil Engineering & Technology · Vol. 15, Issue 2, 2025 · pp. 19–24 Read article
-
Zebrafish in Drug Research: Decoding Biological Mechanisms and Finding Novel Therapeutic Targets
Abstract: The zebrafish, scientifically known as Danio rerio, is a powerful model organism in biological research because of its favorable traits, which include rapid development, genetic tractability, and transparent embryos. Zebrafish were first identified for their use in studies of vertebrate development, but they have since spread to a variety of disciplines, such as pharmacology, clinical research as a disease model, and most notably, drug development. Zebrafish have emerged as a …
Published in Research and Reviews: A Journal of Toxicology · Vol. 15, Issue 3, 2025 · pp. 1–8 Read article
-
Comparative Analysis of Serial and Parallel Robot Mechanisms for Industrial Automation
Abstract: Serial and parallel manipulators represent two major mechanical architectures in industrial automation, each with distinct strengths and trade-offs. This study presents a detailed comparative analysis of serial-chain (open-kinematic) robots and parallel-kinematic manipulators (PKMs) with a focus on industrial automation tasks. It covers kinematics, static accuracy and stiffness, dynamics and actuation requirements, control and calibration burdens, workspace and singularity behaviour, and practical industrial considerations (cost, integration, safety, maintenance). Serial robots, exemplified …
Published in International Journal of Robotics and Automation in Mechanics · Vol. 3, Issue 2, 2025 · pp. 22–26 Read article