Interpreting vibrational circular dichroism spectra: the Cai•factor for absolute configuration with confidence by Jonathan Lam, Richard J. Lewis, Jonathan M. Goodman

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31ièmes Journées Franco-Belges de Pharmacochimie: Meeting Report by Raphaël Frédérick, Lionel Pochet, Pascal De Tullio, François Dufrasne

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2‑Amino Thiazole Derivatives as Prospective Aurora Kinase Inhibitors against Breast Cancer: QSAR, ADMET Prediction, Molecular Docking, and Molecular Dynamic Simulation Studies by Sivakumar Bathula, Murugesan Sankaranarayanan, Beutline Malgija, Ilango Kaliappan, Richie R. Bhandare, Afzal B. Shaik

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Structural Biology-Based Exploration of Subtype-Selective Agonists for Peroxisome Proliferator-Activated Receptors by Hiroyuki Miyachi

“…This review summarizes our medicinal chemistry research of more than 20 years on the design, synthesis, and pharmacological evaluation of subtype-selective PPAR agonists, which has been based on two working hypotheses, the ligand superfamily concept and the helix 12 (H12) holding induction concept. …”
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A Mechanistic Study on the Formation of Dronic Acids by Péter Ábrányi-Balogh, István Greiner, György Keglevich

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Graph theoretical network analysis, in silico exploration, and validation of bioactive compounds from Cynodon dactylon as potential neuroprotective agents against α-synuclein by Raja Rajeswari Rajeshkumar, Banoth Karan Kumar, Pavadai Parasuraman, Theivendren Panneerselvam, Krishnan Sundar, Damodar Nayak Ammunje, Sureshbabu Ram Kumar Pandian, Sankaranarayanan Murugesan, Shanmugampillai Jeyarajaguru Kabilan, Selvaraj Kunjiappan

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Concept of Hybrid Drugs and Recent Advancements in Anticancer Hybrids by Ankit Kumar Singh, Adarsh Kumar, Harshwardhan Singh, Pankaj Sonawane, Harshali Paliwal, Suresh Thareja, Prateek Pathak, Maria Grishina, Mariusz Jaremko, Abdul-Hamid Emwas, Jagat Pal Yadav, Amita Verma, Habibullah Khalilullah, Pradeep Kumar

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In silico anti-viral assessment of phytoconstituents in a traditional (Siddha Medicine) polyherbal formulation – Targeting Mpro and pan-coronavirus post-fusion Spike protein by Sumit Kumar Mandal, MD Muzaffar-Ur Rehman, Ashish Katyal, Kanishk Rajvanshi, Manoj Kannan, Mohit Garg, Sankaranarayanan Murugesan, P.R. Deepa

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Overview on the recently developed coumarinyl heterocycles as useful therapeutic agents by B.S. Jayashree, Sukriti Nigam, Aravinda Pai, P.V.R. Chowdary

“…Attempts made in the continuous chemical diversification of this parent nucleus have brought significant alterations in the biological activity among the generated compounds and therefore, this category of benzopyrones has been much exploited in the current medicinal chemistry research. Thus, it was thought worthwhile to present a review on the newly synthesised heterocyclic coumarinyl derivatives with their physicochemical parameters and biological activity, attempted by our co-workers. …”
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Microwave-assisted synthesis, characterization and biological activity of novel pyrazole derivatives by Theivendren Panneer Selvam, Palanirajan Vijayaraj Kumar, Govindaraj Saravanan, Chinnasamy Rajaram Prakash

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Biological potential of thiazolidinedione derivatives of synthetic origin by Sucheta, Sumit Tahlan, Prabhakar Kumar Verma

“…Therefore seems to be a requirement to collect recent information in order to understand the current status of the thiazolidinedione nucleus in medicinal chemistry research, focusing in particular on the numerous attempts to synthesize and investigate new structural prototypes with more effective antidiabetic, antimicrobial, antioxidant, anti-inflammatory, anticancer and antitubercular activity.…”
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Artificial intelligence-open science symbiosis in chemoinformatics by Filip Miljković, José L. Medina-Franco

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Harnessing Luteolin's therapeutic potential in human disorders: Medicinal significance, biological, clinical properties and analytical aspects by Abhishek Singh, Seema Yadav, Prateek Pathak, Amita Verma, Jagat Pal Yadav

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Wound healing, antidiabetic and antioxidant activity of Neolamarckia cadamba, quercetin rich, extract by Jagat Pal Yadav, Amita Verma, Prateek Pathak, Vikas Kumar, Dinesh Kumar Patel

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Bacterial extracellular vesicles: towards realistic models for bacterial membranes in molecular interaction studies by surface plasmon resonance by Maxim S. Bril’kov, Victoria Stenbakk, Martin Jakubec, Terje Vasskog, Tone Kristoffersen, Jorunn Pauline Cavanagh, Johanna U. Ericson, Johan Isaksson, Johan Isaksson, Gøril Eide Flaten

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Comprehensive Review of Recent Advances in Chiral A-Ring Flavonoid Containing Compounds: Structure, Bioactivities, and Synthesis by Changyue Zhang, Yanzhi Liu, Xiaojing Liu, Xiaochuan Chen, Ruijiao Chen

“…The desirable development of chiral A-ring-containing flavonoids by isolation, semi-synthesis or total synthesis in a short duration proves their great value in medicinal chemistry research. In this review, the research progress of chiral A-ring-containing flavonoids, including isolation and extraction, structural identification, pharmacological activities, and synthetic methods, is comprehensively and systematically summarized. …”
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TiO₂–Fe₃O₄ Composite Systems—Preparation, Physicochemical Characterization, and an Attempt to Explain the Limitations That Arise in Catalytic Appli... by Rafal Krakowiak, Robert Frankowski, Kinga Mylkie, Dariusz T. Mlynarczyk, Marta Ziegler-Borowska, Agnieszka Zgoła-Grześkowiak, Tomasz Goslinski

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Creating Designer Engineered Extracellular Vesicles for Diverse Ligand Display, Target Recognition, and Controlled Protein Loading and Delivery by Alena Ivanova, Lukas Badertscher, Gwen O'Driscoll, Joakim Bergman, Euan Gordon, Anders Gunnarsson, Camilla Johansson, Michael J. Munson, Cristiana Spinelli, Sara Torstensson, Liisa Vilén, Andrei Voirel, John Wiseman, Janusz Rak, Niek Dekker, Elisa Lázaro‐Ibáñez

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Computational Approaches to Enzyme Inhibition by Marine Natural Products in the Search for New Drugs by Federico Gago

“…Marine natural products are viewed today not only as potential drugs, but also as an invaluable source of chemical inspiration for the development of novel chemotypes to be used in chemical biology and medicinal chemistry research.…”
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Quercetin and Related Chromenone Derivatives as Monoamine Oxidase Inhibitors: Targeting Neurological and Mental Disorders by Priyanka Dhiman, Neelam Malik, Eduardo Sobarzo-Sánchez, Eugenio Uriarte, Anurag Khatkar

“…This has encouraged many medicinal chemistry research groups for the development of most promising selective monoamine oxidase (MAO) inhibitors. …”
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