Free energy perturbation-assisted identification of checkpoint kinase 1 targeted small-molecule inhibitors for cancer therapy using AI- and physics-driven molecular design

Computational Biology and Chemistry 2026

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Authors: Md Ataul Islam, Mohammad Ajmal Ali, Rupesh Chikhale, Md Lutful Islam, Saikh Mohammad Wabaidur

DOI: 10.1016/j.compbiolchem.2026.109203

Cited by: 1

References: 48

Fields of Study & Subjects

DNA Repair Mechanisms Melanoma and MAPK Pathways Microtubule and mitosis dynamics

References 48