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Exploring the potent inhibitors and binding modes of phospholipase A2 through in silico investigation.

Autor: Mahmud, Shafi, Parves, Md. Rimon, Riza, Yasir Mohamed, Sujon, Khaled Mahmud, Ray, Suvendu, Tithi, Fahmida Alam, Zaoti, Zannati Ferdous, Alam, Sanjida, Absar, N.

Publikováno v: Journal of Biomolecular Structure & Dynamics; Sep2020, Vol. 38 Issue 14, p4221-4231, 11p

Molecular dynamics-based insight of VEGFR-2 kinase domain: a combined study of pharmacophore modeling and molecular docking and dynamics.

Autor: Parves MR; Department of Biochemistry and Biotechnology, Faculty of Basic Medical and Pharmaceutical Sciences, University of Science and Technology Chittagong (USTC), Foy's Lake, Khulshi, 4202, Chittagong, Bangladesh. rimonriju@gmail.com., Riza YM; Department of Biochemistry and Biotechnology, Faculty of Basic Medical and Pharmaceutical Sciences, University of Science and Technology Chittagong (USTC), Foy's Lake, Khulshi, 4202, Chittagong, Bangladesh., Alam S; Department of Biochemistry and Biotechnology, Faculty of Basic Medical and Pharmaceutical Sciences, University of Science and Technology Chittagong (USTC), Foy's Lake, Khulshi, 4202, Chittagong, Bangladesh., Jaman S; Department of Genetic Engineering & Biotechnology, Jagannath University, Dhaka, 100, Bangladesh.

Publikováno v: Journal of molecular modeling [J Mol Model] 2022 Dec 23; Vol. 29 (1), pp. 17. Date of Electronic Publication: 2022 Dec 23.