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Research Articles

In silico molecular docking study of Andrographis paniculata phytochemicals against TNF-α as a potent anti-rheumatoid drug

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Pages 2687-2697 | Received 23 Jan 2021, Accepted 26 Jan 2022, Published online: 11 Feb 2022

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Noor Zafirah Ismail, Wan Ahmad Syazani Mohamed, Nurhidayah Ab. Rahim, Nor Munira Hashim, Ismail Abiola Adebayo, Nur Nadhirah Mohamad Zain & Hasni Arsad. (2023) Molecular docking and molecular dynamic simulations of apoptosis proteins with potential anticancer compounds present in Clinacanthus nutans extract using gas chromatography–mass spectrometry. Journal of Biomolecular Structure and Dynamics 41:13, pages 6104-6120.
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G. Vamshi, Prasanth D. S. N. B. K.A. Sampath, Manjunath Dammalli, Pankaj Kumar, Gowrishankar B.S.Praveen Kumar Pasala, G. Somasekhar, Madhusudhana Chetty Challa, Ramesh Alluril & Venkata Ramireddy Narala. (2023) Possible cerebroprotective effect of citronellal: molecular docking, MD simulation and in vivo investigations. Journal of Biomolecular Structure and Dynamics 0:0, pages 1-12.
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Trixia Julaton, Aibelou Taclendo, Glenn Oyong, Ofelia Rempillo, Maria Cecilia Galvez & Edgar Vallar. (2022) In Silico Insights on the Pro-Inflammatory Potential of Polycyclic Aromatic Hydrocarbons and the Prospective Anti-Inflammatory Capacity of Andrographis paniculata Phytocompounds. International Journal of Environmental Research and Public Health 19:14, pages 8588.
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