article · Journal of Biomolecular Structure and Dynamics

Design of new Mcl-1 inhibitors for cancer using fragments hybridization, molecular docking, and molecular dynamics studies

Abdulrahim A. Alzain
Shaimaa G. A. Mohamed
Samar F. Miski
Kholoud F. Ghazawi
Gamal A. Mohamed
Bayan E. Ainousah
Rua M. Mukhtar
Fatima A. Elbadwi
Marwa Alsulaimany
Nihal Abdelmoniem
Tagyedeen H. Shoaib
Hazem G. A. Hussein
Sabrin R. M. Ibrahim

202310 citationsBritish University in Egypt

Abstract

approaches, these techniques prove to be invaluable for identifying novel drug candidates with distinct therapeutic applications using fragment-based drug design. This methodology has the potential to expedite the drug discovery process while also reducing its costs.Communicated by Ramaswamy H. Sarma.

Research topics

Computational Drug Discovery Methods
Cell death mechanisms and regulation
Synthesis and biological activity

Sustainable Development Goals

Good Health and Well-being

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DOI: 10.1080/07391102.2023.2281637

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