Browsing by Subject Molecular docking

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Showing results 1 to 16 of 16
Issue DateTitleAuthor(s)
2023Antioxidant and antithrombotic activities of the distichochlamys citrea leaves extractNguyen, Thi Van Anh; Nguyen, Thi Kieu Oanh; Nguyen³, Nhung Phuong; Le, Hong Luyen
2023Essential oil of syzygium boisianum (Gagnep.) Merr. & L.M.Perry: Chemical compositions, antimicrobial activity, and molecular dockingLe, Thi Huong; Nguyen, Thi Chung; Dau, Xuan Duc; Do, Ngoc Dai; Pham, The Hai; Ninh, The Son
2023Hydrazineylidene-3-oxopropanal derivatives as antiviral agents for treatment of HBV and HCV: Experimental, DFT, and molecular docking studiesBenjamin, Innocent; Louis, Hitler; Udoikono, Akaninyene D.; Agwamba, Ernest C.; Unimuke, Tomsmith O.; Ahuekwe, Eze F.
2024In silico molecular docking and ADMET study of Isodon coetsa phytochemicals targeting TNF-α in inflammation-mediated diseasesNguyen, Xuan Ha; Cao, Hong Le
2023In silico screening for anti-Zika Virus compounds from Eclipta prostrata by molecular dockingHo, Thien Hoang; Nguyen, Thi Uyen Thanh; Dang, Quoc Quan; Nguyen, Thi Kim Tuyen; Nguyen, Trang H. D.; Bui, Dinh Thach
2023In silico screening of alkaloids as potential inhibitors of HER2 protein for breast cancer treatmentBui, Thanh Tung; Nguyen, Nhu Son; Nguyen, Bao Kim; Do, Thi Hong Khanh; Phan, Hong Minh
2021In silico studies of natural products from medicinal plants to identify potential inhibitors for SARS-CoV-2 3C-like proteaseNguyen, Tan Khanh; Tran, Thanh Hoa
2020Initial study on SARS-COV-2 main protease inhibition mechanism of some potential drugs using molecular docking simulationPham, Minh Quan; Le, Thi Thuy Huong; Tran, Quoc Toan; Ngo, Son Tung; Nguyen, Trong Dan; Tran, Thi Thuy Thuy; Nguyen, Manh Cuong; Pham, Quoc Long
2020Initial study on sars-cov-2 main protease inhibition mechanism of some potential drugs using molecular docking simulationPham, Minh Quan; Le, Thi Thuy Huong; Tran, Quoc Toan; Ngo, Son Tung; Nguyen, Trong Dan; Tran, Thi Thu Thuy; Nguyen, Manh Cuong; Pham, Quoc Long
2021Modified bis-tetrahydrofuran inhibitors toward improved binding to HIV-1 proteasesP. Paulin, John; C. Franco Jr, Francisco
2024Molecular docking and molecular dynamics approach to identify EGFR and HER2 receptors inhibitory effect of compounds in Zanthoxylum simulans HanceTran, Hoang Mai; Le, Thi Huong; Vu, Manh Ha; Nguyen, Thi Thuy; Do, Thi Hong Khanh; Bui, Thanh Tung
2024Pancreatic lipase inhibitory and antiacne activity of Piper betle: Kinetic studies, in silico docking, and chemical characterization of bioactive compoundsShinde, Rani A.; Patil, Mohini R.; Patil, Ravindra H.; Vishwakarma, Kishor S.; Maheshwari, Vijay L.
2018Sàng lọc các chất có hoạt tính ức chế enzym arginase 2 bằng phương pháp in silicoLê, Minh Trí; Huỳnh, Nam Hải; Thái, Khắc Minh
2021Synthesis, characterization and biological activity of mixed ligand chelates of Ni(ll) with pyridoxalthiosemicarbazone and dipeptidesSaritha, A.; Reddy, Ch. Venkata Ramana; Sireesha, B.
2023Synthesis, spectral characterization, DFT studies, and computational screening of 4-amino-3-mercapto-5-methyl-1,2,4-triazole and its cadmium(II) mixed ligands complexes as potential antimalaria drugA. Eno, Ededet; E. D. Okon, Emmanuel; Louis, Hitler; U. Obot, Nsikanabasi; A. Adalikwu, Stephen; O. Unimuke, Tomsmith; E. Gber, Terkumbur; G. Chukwu, Udochukwu; Ekoja, Paulworship; Ogar, Joseph; E. Owen, Aniekan; E. Offiong, Offiong
2024Unveiling the potential of Satureja calamintha nepeta: A study on its phytochemical composition and antibacterial activityHayani, Mouhcine; Benabbouha, Tariq; Nachit, Wafaa; Byadi, Said; Chefiras, Khalil; Aboulmouhajir, Aziz; Tounsi, Abdessamad; Zair, Touriya