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55 articles for “AI in chemistry”
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Climate Change and Air Pollution Dynamics: Synergistic Effects and Mitigation Strategies
Abstract: Climate change and air pollution are deeply interlinked environmental problems that jointly exacerbate human health, ecosystem integrity, and economic well‑being. As global temperatures rise, shifts in meteorological conditions—such as increased heat, altered precipitation, and more frequent extreme weather events—modify pollutant generation, dispersion, chemical transformation, and removal processes. Meanwhile, many sources of air pollution are also sources of greenhouse gases (GHGs), giving rise to potential co‑benefits or trade‑offs when formulating mitigation …
Published in International Journal of Environmental Noise and Pollution Control · Vol. 3, Issue 2, 2025 · pp. 38–42 Read article
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Investigation of the Effects of Physicochemical Behaviour, Design, and Contaminants on Corrosion Mechanisms for Coatings
Abstract: Advanced coating systems have been developed to address the challenges of coating life and corrosion mechanisms in various industries. These coating systems are designed to provide enhanced protection, prolong the lifespan of coated surfaces, and reduce the effects of corrosion. A corrosion study with respect to contaminants (water soluble salts like sulphates, chlorides and nitrates etc.), design of the components (macro and micro defects developed due to improper design and …
Published in Journal of Polymer & Composites · Vol. 12, Issue 3, 2024 · pp. 44–54 Read article
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Interfacial and Tribo-Mechanical Performance of a TiO₂–Castor Oil Polymeric Nanofluid During Sustainable Machining of AISI 316L Stainless Steel Under MQL Conditions
Abstract: This research examines the tribo-mechanical performance and interfacial film characteristics of a TiO₂-reinforced castor-oil polymeric nanofluid during the turning of AISI 316L stainless steel under minimum-quantity lubrication (MQL). A Taguchi L9 orthogonal array was utilized to assess the synergistic effects of cutting speed, depth of cut, and coolant composition on surface integrity, while machining experiments were performed under dry, conventional, and TiO₂-nanofluid lubrication techniques. ANOVA and multiple-regression modeling were used …
Published in Journal of Polymer & Composites · Vol. 14, Issue 1, 2026 · pp. 901–914 Read article
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QSAR Modeling Techniques: A Comprehensive Review of Tools and Best Practices
Abstract: Quantitative Structure–Activity Relationship (QSAR) modeling has become an essential tool in drug discovery, toxicity assessment, and environmental chemistry. By correlating chemical structure with biological activity or toxicity, QSAR enables the prediction of compound behavior without extensive experimental testing. This approach not only saves time and resources but also supports ethical practices by reducing reliance on animal studies. The evolution of QSAR from basic linear models to advanced machine learning and …
Published in International Journal of Cheminformatics · Vol. 3, Issue 1, 2025 · pp. 56–63 Read article
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Container transportation in marine terminals and marine transportation infrastructure on the increase in export market share
Abstract: In order to achieve important policy goals like increasing global competitiveness, diversifying import sources, opening up new markets, and forging strategic partnerships, maritime transportation is essential. It also has a significant impact on reducing the economic vulnerability of nations that rely on the sale of gas and oil by carefully choosing its clients and growing the export of petroleum products, petrochemicals, and gas. This study develops a two-objective mathematical planning …
Published in Journal of Petroleum Engineering & Technology · Vol. 14, Issue 1, 2024 · pp. 36–42 Read article
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Mapping the Landscape of Neem Tree Research: Insights into Chemicals and Polymers through Bibliometric Exploration
Abstract: Azadirachta indica A. Juss, often referred to as Neem, is a rapidly developing tree that falls under the Meliacea family. For more than two millennia, Indians has relied on neem oil for its healing properties. Thus, to know the importance of neem tree, the study is needed. The Neem tree has been a subject of extensive research owing to its diverse array of chemicals and polymers with multifaceted applications. This …
Published in Journal of Polymer & Composites · Vol. 12, Issue 4, 2024 · pp. 144–154 Read article
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Synthesis and Characterization of Polymer-Based Benzamide Derivatives with Potential Biomedical Applications
Abstract: The present study explores the synthesis and characterization of polymer-supported benzamide derivatives, focusing on their potential biomedical applications. The use of polymer-supported synthesis offers several advantages, including improved reaction efficiency, ease of purification, and reusability of the support material, making it an environmentally friendly and cost-effective approach. The synthesis involved a stepwise reaction sequence, with polymeric supports facilitating controlled functionalization and ensuring high product purity. These materials have been widely …
Published in Journal of Polymer & Composites · Vol. 13, Issue 5, 2025 Read article
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Polymer-Based Ankle-Foot Orthoses: Innovations in Material Selection and Functional Enhancement
Abstract: Ankle-foot orthoses (AFOs) are critical devices in rehabilitative therapy for patients with foot drop due to neurological disorders such as stroke, multiple sclerosis, and cerebral palsy. These conditions impair dorsiflexion, making walking difficult and increasing the risk of falls. Traditional AFOs, often made from rigid thermoplastics, provide support but limit flexibility and patient comfort. Recent advancements in polymer chemistry have introduced innovative materials that enhance the functionality, durability, and effectiveness …
Published in Journal of Polymer & Composites · Vol. 13, Issue 5, 2025 · pp. 49–55 Read article
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Advancements in Zeolite Catalysis for Efficient Oil Refining and Sustainable Energy Production
Abstract: Fossil fuels remain the primary reliable and cost-effective energy source for maintaining the desired product quality. This dominance stems from advancements in petrochemistry and oil refining, driven by substantial investments in research and innovation. The exceptional efficiency of oil refining is largely attributed to the use of zeolites as catalysts, a breakthrough regarded as one of the most significant achievements in modern chemistry. Their applications span across several catalytic processes, …
Published in Journal of Catalyst & Catalysis · Vol. 12, Issue 2, 2025 · pp. 35–42 Read article
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Comprehensive Review of Composite Materials: Classification, Manufacturing Methods, Mechanical Behavior, Failure Modes, and Emerging Applications
Abstract: Composite materials have emerged as one of the most significant classes of engineered materials due to their ability to deliver high strength to weight ratios, enhanced durability, and tailored multifunctionality. Over the past two decades, rapid progress in polymer chemistry, advanced reinforcement architectures, additive manufacturing, and automated fabrication has expanded the applicability of composites across aerospace, automotive, biomedical, civil, and renewable energy sectors. This paper provides a comprehensive review of …
Published in Journal of Polymer & Composites · Vol. 14, Issue 1, 2026 · pp. 923–939 Read article
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Exploring Chocolate’s Potential: A Review of Its Role in Drug Delivery and Health Benefits
Abstract: The abstract explores the versatile nature of chocolate, highlighting its role as a medium for drug delivery systems due to its resistance to microbial growth and rich nutritional profile. Medicated chocolate, infused with drugs, offers a palatable solution to enhance patient compliance, particularly among children, while stimulating serotonin production for added therapeutic benefits. Cocoa, abundant in polyphenols, contributes to chocolate's health advantages, including cholesterol reduction and cardiovascular health. Scientific evidence …
Published in Trends in Drug Delivery · Vol. 11, Issue 2, 2024 · pp. 16–24 Read article
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Evaluating the Efficacy of Implosion Water Treatment Versus Traditional Methods
Abstract: The first worry of all people is the quality of the water. The majority of the water that is accessible is unfit for immediate usage. Certain methods are frequently employed to purify water for optimal use. These methods include UV treatment, chemical treatments, reverse osmosis, filtration, and ultrafiltration, among others. Each of these water treatment methods is applied separately or in combination. There are benefits and drawbacks to each of …
Published in Journal of Water Pollution & Purification Research · Vol. 12, Issue 1, 2025 · pp. 10–21 Read article
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Alkylimidazolium Chloride Ionic Liquids as Green Additives in Rubber Composites: A Comprehensive Review
Abstract: The growing emphasis on sustainable and environmentally friendly materials has underscored the use of ionic liquids (ILs) as green additives in polymer science. Alkylimidazolium chloride ionic liquids (ACLs) have emerged as viable possibilities for improving the performance of rubber composites while minimizing the environmental impact of conventional processing aids. This research conducts a thorough examination of the function of ACls in rubber technology, focusing on their physicochemical features, interaction mechanisms …
Published in Journal of Polymer & Composites · Vol. 13, Issue 4, 2025 · pp. 1–13 Read article
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Harnessing Deep Learning to Explore Microbial Community Structure and Carbon Storage Capacity in Mangrove Ecosystems: A Framework for Computationally
Abstract: Mangrove ecosystems represent one of the most efficient natural carbon sinks on Earth, functioning as critical blue carbon habitats that sustain diverse microbial communities responsible for biogeochemical cycling and long-term carbon storage. Despite their global ecological significance, accurately quantifying and predicting carbon sequestration in mangrove systems remains challenging due to the complex interactions between microbial diversity, sediment chemistry, and environmental drivers. This study presents a comprehensive and sustainable artificial intelligence …
Published in Research and Reviews : Journal of Computational Biology · Vol. 15, Issue 1, 2026 Read article
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Secondary Metabolites in Drug Development: Tracing Their Historical and Therapeutic Impact
Abstract: Secondary metabolites, also known as natural products, exhibit a level of structural and chemical diversity unmatched by synthetic small molecule libraries. These compounds, which have evolved to possess drug-like properties, continue to be a primary source for new medications and drug leads. Their discovery has significantly impacted advancements in chemistry, biology, and medicine, influencing drug development and therapeutic strategies throughout history. Derived from primary metabolic pathways such as photosynthesis, glycolysis, …
Published in Emerging Trends in Metabolites · Vol. 1, Issue 2, 2024 · pp. 51–55 Read article