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DFT investigation of mercaptopurine adsorption and molecular interactions on pristine and Ga-doped boron nitride T-graphene nanosheets

Mutaz Jamal Al-khreisatFaculty of Allied Medical Sciences, Hourani Center for Applied Scientific Research, Al-Ahliyya Amman University, Amman, JordanOmar FadaamCollege of Pharmacy, Department of Pharmaceutical Sciences, Al-Turath University, Baghdad, IraqJalpa R. PatelNeerja KumariSharda School of Pharmacy, Sharda University, Knowledge Park III, Greater Noida, IndiaYodgor KenjaevDepartment of Basic Medical Sciences, Termez University of Economics and Service, Termez, UzbekistanNasiba JumaniyazovaDepartment of Psychology, Mamun University, Khiva, UzbekistanMaryam Abdul Al-HusseinDepartment of Medical Laboratory Technologies, College of Medical Technologies, The Islamic University, Najaf, IraqChandan SharmaUniversity Institute of Pharma Sciences, Chandigarh University, Mohali, Punjab, India

2026en

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ABI

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DOI: 10.1016/j.comptc.2026.116109

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