In-silico design of some pyrazolopyridine analogs as breast cancer inhibitors: QSAR modeling,molecular docking,MD simulation,and pharmacological features profiling |
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| Institution: | 1. Department of Chemistry, Faculty of Physical Sciences, Ahmadu Bello University, P.M.B.1045, Zaria, Kaduna State, Nigeria;2. Faculty of Veterinary Medicine, University of Calgary, Alberta, Canada;1. School of Applied Science and Humanities, Haldia Institute of Technology, Haldia, 721657, India;2. Departments of Chemistry, Cooch Behar Panchanan Barma University, Cooch Behar, 736101, India;3. Center for Basic Sciences, Pt. Ravishankar Shukla University, Raipur, 492010, (C.G), India;4. Mechanical and Construction Engineering, Faculty of Engineering and Environment, Northumbria University, Newcastle Upon Tyne, NE1 8ST, UK;5. College of Materials Science and Engineering, Taiyuan University of Science and Technology, Taiyuan, 030024, China;1. Department of Chemistry, GLA University, Mathura, 281406, India;2. Department of Chemistry, Kalindi College, University of Delhi, Delhi, 110008, India;3. Department of Chemistry, Shyamlal College, University of Delhi, Delhi, 110032, India;4. Department of Chemistry, Faculty of Science, Agriculture and Engineering, University of Zululand, P/Bag X1001, KwaDlangezwa, 3886, South Africa;1. Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria;2. Department of Pure and Applied Chemistry, University of Calabar, Calabar, Nigeria;3. Department of Biochemistry, University of Calabar, Nigeria;4. Department of Chemistry, Modibbo Adama University Yola, Nigeria;5. Department of Chemical Sciences, Federal University Wukari, Wukari, Nigeria;2. Guangdong Key Laboratory for Hydrogen Energy Technologies, Foshan University, Foshan, 528000, PR China;3. Huizhou LCY Elastomers Corp., Huizhou, 516082, Guangdong Province, PR China |
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| Abstract: | |
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| Keywords: | QSAR modeling Breast cancer Estrogen receptor Molecular docking |
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