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In-silico discovery of Dipeptidyl Peptidase-4 inhibitors from African medicinal plants: Molecular docking, ADMET, dynamics simulation, and MM-GBSA analyses.

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Title: In-silico discovery of Dipeptidyl Peptidase-4 inhibitors from African medicinal plants: Molecular docking, ADMET, dynamics simulation, and MM-GBSA analyses.
Authors: Akinwumi, Ishola Abeeb1 (AUTHOR) akinwumiishola5000@gmail.com, Rabie, Amgad M.2 (AUTHOR) amgadpharmacist1@yahoo.com, Katiyar, Kalpana3 (AUTHOR) kalpna@aith.ac.in, Ajayi, Adeola4,5 (AUTHOR) ajayideola21@gmail.com, Bello, Ridwan Opeyemi5,6 (AUTHOR) belloridwanopeyemi@gmail.com, Aborode, Abdullahi Tunde7 (AUTHOR) abdullahiaborodet@gmail.com, Moin, Abu Tayab8 (AUTHOR) tayabmoin29@gmail.com, Ferdoush, Jannatul9 (AUTHOR) jannat_fkh@yahoo.com, Ogunyemi, Adedeji10 (AUTHOR) aogunyem@ttu.edu, Etinosa, Precious11 (AUTHOR) poetinosa@wpi.edu, Osinuga, Abraham12 (AUTHOR) aosinuga2@huskers.unl.edu, Obadawo, Babatunde Samuel13 (AUTHOR) sobadawo@gmail.com, Awolola, Victoria Gbonjubola14 (AUTHOR) vicky@unilorin.edu.ng, Awaji, Aeshah Ali Ahmad15 (AUTHOR) aawaji@ut.edu.sa, Umar, Haruna Isiyaku4,5 (AUTHOR), Adesola, Ridwan Olamilekan16 (AUTHOR) adesolaridwanolamilekan@gmail.com, Adio, Waheed Sakariyau17 (AUTHOR) waheedsackson@gmail.com, Adeoye, Bisi Olajumoke18 (AUTHOR) adeoyebisi2014@gmail.com, Adeyemo, Oluwatosin M.4 (AUTHOR), Adeyanju, Anne Adebukola19 (AUTHOR) anne.adeyanju@koladaisiuniversity.edu.ng
Source: Nucleus (0029568X). Mar2026, Vol. 69 Issue 1, p75-97. 23p.
Database: Academic Search Ultimate
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  Data: <searchLink fieldCode="JN" term="%22Nucleus+%280029568X%29%22">Nucleus (0029568X)</searchLink>. Mar2026, Vol. 69 Issue 1, p75-97. 23p.
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