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44 articles for “ADME screening”
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In Silico Molecular Docking Studies of Phytocompounds from Melissa officinalis Against MPXV Poxin Target
Abstract: Objectives: This study aimed to evaluate the inhibitory potential of phytocompounds of Melissa officinalis against the MPXV poxin protein target, a key virulence factor in monkeypox infection. Methods: Molecular docking performed using PyRx, a virtual screening software, was conducted to predict the binding affinities of the compounds to MPXV poxin. Prior to docking, the compounds were subjected to comprehensive analysis, including Lipinski's rule of five, evaluation of physicochemical properties, pharmacological …
Published in Research and Reviews : Journal of Computational Biology · Vol. 13, Issue 2, 2024 · pp. 25–38 Read article
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Exploring Recent Advancements in Nanomedicine for Tumor Microenvironmental Tissue Engineering
Abstract: The combination of tissue engineering and nanomedicine is transforming cancer treatment by offering creative ways to get around problems with conventional therapies. Recent developments in nanomedicine are examined in this review, with an emphasis on how they might be used to comprehend and control the tumor microenvironment (TME), a dynamic and complex environment that has a major impact on the course of cancer and the effectiveness of treatment. Targeted interactions …
Published in Research and Reviews: A Journal of Pharmaceutical Science · Vol. 16, Issue 3, 2025 · pp. 122–136 Read article
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Structure–Property Modeling of Cement-Based Multi-Component Composites Using Ensemble Machine Learning and Explainable Feature Attribution
Abstract: Accurate prediction of compressive strength is central to structure–property optimization, quality control, and sustainability-driven design in cement-based composite materials. Cementitious systems represent heterogeneous multi-phase composites composed of reactive binder matrices and dispersed aggregate phases, whose macroscopic mechanical performance emerges from complex nonlinear interactions among constituents and curing-dependent microstructural evolution. This study develops a data-driven structure–property modeling framework to quantify the nonlinear dependence of compressive strength on multi-component composite composition and …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 112–131 Read article
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A Retrospective Study to Assess the Incidence of Anaemia Among Pregnant Women Admitted in a Tertiary Care Centre, Jalandhar, Punjab
Abstract: Background: Anemia during pregnancy is a common and preventable condition that contributes significantly to adverse maternal and neonatal outcomes, including preterm delivery, low birth weight, and increased maternal morbidity. Despite the implementation of various national health programs in India, the burden of anemia among pregnant women remains high, particularly in rural regions. Objective: To assess the incidence and severity of anemia among pregnant women admitted to a tertiary care center …
Published in International Journal of Women's Health Nursing And Practices · Vol. 3, Issue 2, 2025 · pp. 38–42 Read article