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Khattab Al-Khafaji & Tugba Taskin Tok. (2021) Amygdalin as multi-target anticancer drug against targets of cell division cycle: double docking and molecular dynamics simulation. Journal of Biomolecular Structure and Dynamics 39:6, pages 1965-1974.
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Khattab Al-Khafaji & Tugba Taskin Tok. (2021) Understanding the mechanism of amygdalin’s multifunctional anti-cancer action using computational approach. Journal of Biomolecular Structure and Dynamics 39:5, pages 1600-1610.
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Kayode Ezekiel Adewole & Ahmed Adebayo Ishola. (2019) Phytosterols and triterpenes from Morinda lucida Benth (Rubiaceae) as potential inhibitors of anti-apoptotic BCL-XL, BCL-2, and MCL-1: an in-silico study. Journal of Receptors and Signal Transduction 39:1, pages 87-97.
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Chang-Ming Su, Gui-Ge Hou, Chun-Hua Wang, Hong-Qin Zhang, Cheng Yang, Mei Liu & Yun Hou. (2019) Potential multifunctional agents with anti-hepatoma and anti-inflammation properties by inhibiting NF-кB activation. Journal of Enzyme Inhibition and Medicinal Chemistry 34:1, pages 1287-1297.
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Ramya Mathiyalagan, Yeon Ju Kim, Chao Wang, Yan Jin, Sathiyamoorthy Subramaniyam, Priyanka Singh, Dandan Wang & Deok Chun Yang. (2016) Protopanaxadiol aglycone ginsenoside-polyethylene glycol conjugates: synthesis, physicochemical characterizations, and in vitro studies. Artificial Cells, Nanomedicine, and Biotechnology 44:8, pages 1803-1809.
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Fayeza M. Siraj, Sathishkumar Natarajan, Yeon Ju Kim & Deok Chun Yang. (2015) In silico screening of ginsenoside Rh1 with PPARγ and in vitro analysis on 3T3-L1 cell line. Molecular Simulation 41:15, pages 1219-1226.
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Fayeza Md. Siraj, Natarajan SathishKumar, Yeon Ju Kim, Se Young Kim & Deok Chun Yang. (2015) Ginsenoside F2 possesses anti-obesity activity via binding with PPARγ and inhibiting adipocyte differentiation in the 3T3-L1 cell line. Journal of Enzyme Inhibition and Medicinal Chemistry 30:1, pages 9-14.
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Ramya Mathiyalagan, Sathiyamoorthy Subramaniyam, Yeon Ju Kim, Sathishkumar Natarajan, Jin Woo Min, Se Young Kim & Deok Chun Yang. (2014) Synthesis and pharmacokinetic characterization of a pH-sensitive polyethylene glycol ginsenoside CK (PEG-CK) conjugate. Bioscience, Biotechnology, and Biochemistry 78:3, pages 466-468.
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Omar Noman, Fahd A. Nasr, Mohammad Z. Ahmed, Md Tabish Rehman, Wajhul Qamar, Ali S. Alqahtani & Sebastian Guenther. (2023) Assessment of the Anticancer Effect of Chlorojanerin Isolated from Centaurothamnus maximus on A549 Lung Cancer Cells. Molecules 28:7, pages 3061.
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Mahla Lashkari, Ahmad Fatemi, Hajar Mardani Valandani & Roohollah Mirzaee Khalilabadi. (2022) Promising anti-leukemic effect of Zataria multiflora extract in combination with doxorubicin to combat acute lymphoblastic leukemia cells (Nalm-6) (in vitro and in silico). Scientific Reports 12:1.
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Malik Suliman Mohamed, Hany A. M. Elsherief, Hani Mohamed Hafez, Omar Awad Alsaidan, Samil I. Alzarea & Asmaa M. AboulMagd. (2022) Synthesis, antiproliferative activity, and molecular modeling of novel 4-methylcoumarin derivatives and/or nitric oxide donor hybrids. Molecular Diversity.
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Khattab Al-Khafaji & Tugba Taskin Tok. (2020) Molecular dynamics simulation, free energy landscape and binding free energy computations in exploration the anti-invasive activity of amygdalin against metastasis. Computer Methods and Programs in Biomedicine 195, pages 105660.
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