Plant lignan compounds show direct binding to EGFR in computational and lab study
An integrated computational and biophysical study found that cleistanthin A and diphyllin derivatives bind the EGFR tyrosine kinase domain, with ...
Tag: molecular docking
Cyclodextrin Hosts Show Selective Molecular Recognition of Three Common Pesticides
Molecular docking analysis shows beta-cyclodextrin binds Atrazine and 2,4-D most favorably, while gamma-cyclodextrin best accommodates the bulkier Chlorpyrifos.
Computational Tools Take Center Stage in Designing Nanoparticle Cancer Drug Delivery
A new review in Clinical and Experimental Medicine examines how molecular dynamics, docking, machine learning and AI platforms are being ...
Four Decades of Anticancer Quinazoline Research Mapped in New Bibliometric Study
A new bibliometric and pharmacological review of 423 Scopus-indexed publications maps four decades of anticancer quinazoline research, revealing a 2018 ...
Molecular Docking Emerges as a Central Tool in PET Probe Development
A new review describes how molecular docking now supports PET probe development from virtual screening to tau tracer evaluation, while ...
Lesser Chickweed Extracts Show Antioxidant and Antimicrobial Activity in Lab Screening
Methanol extracts of lesser chickweed from Egypt showed the strongest phenolic content, antioxidant scavenging, and antimicrobial activity in new laboratory ...
Dansyl-Labeled Aldazine Probe Reveals How Conformation Blocks Protein Glycation
A dansyl-tagged aldazine probe inhibits fructose- and methylglyoxal-driven BSA glycation from early Amadori products to advanced cross-links through conformation-selective binding ...
Two Collagen Peptides from Pig Skin Shield Skin Cells from UV Damage
Researchers identified two porcine skin collagen peptides, FGPYGF and GPPSGGFG, that protected UVB-damaged human keratinocytes in cell culture by acting ...
Macrophage-linked biomarkers flagged for esophageal cancer chemoradiotherapy response in computational study
A computational study identified KRT14 and MMP10 as macrophage-associated candidate biomarkers of chemoradiotherapy response in esophageal squamous cell carcinoma.
Gut Microbe and Gene Candidates Nominated for Inflammatory Myopathies
A multi-omics study computationally nominates the gut microbe Lachnoclostridium and the gene ENO1 as candidates in inflammatory myopathies, with cell ...
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Mothers who receive childcare support from maternal grandparents show more parental warmth, finds NTU Singapore study
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University of Seville Breaks 120-Year-Old Mystery, Revises a Key Einstein Concept
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Bee body mass, pathogens and local climate influence heat tolerance
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Researchers record first-ever images and data of a shark experiencing a boat strike
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Groundbreaking Clinical Trial Reveals Lubiprostone Enhances Kidney Function
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