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Computational identification of Mcl-1 inhibitors through molecular docking, ADMET, QSAR, and molecular dynamics simulations: anti-leukemic phytocompounds

  • Haruna Isiyaku Umar*
  • , Temitope Emmanuel Alabi
  • , Neeraj Kumar
  • , Najwa Ahmad Kuthi
  • , Omoboyede Victor
  • , Ibrahim Akindeji Makinde
  • , Idayat Oyinkansola Kehinde
  • , Ridwan Opeyemi Bello
  • , Abdullahi Tunde Aborode
  • , Mohammed M. Alshehri
  • , Ahmed F. Alanazi
  • , Abdulaziz H. Al Khzem
  • , Mansour S. Alturki
  • , Mohamed S. Gomaa
  • *Corresponding author for this work
  • Federal University of Technology, Akure
  • Computer-Aided Therapeutic Discovery and Design Laboratory
  • Bhupal Nobles' University
  • Universiti Teknologi Malaysia
  • University of Queensland
  • Mississippi State University
  • Ministry of National Guard Health Affairs
  • Imam Abdulrahman Bin Faisal University

Research output: Contribution to journalArticlepeer-review

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Pharmacology, Toxicology and Pharmaceutical Science