Pistagremic acid from Pistacia integerrima as a natural multi-target candidate tackling crucial enzymes involved in Alzheimer's disease. - Muhammad Asim; Marryum; Saima Naz; Abdur Rauf; Nouman Aslam; Umer Rashid; Zuneera Akram; Walaa F. Alsanie; Abdulhakeem S. Alamri; Amal F. Alshammary; Giovanni Ribaudo (J. Comput. Aided Mol. Des., 2026)

Xanthine oxidase inhibitory potential of flavonoids from Pistacia integerrima: insights from molecular docking, MD simulations, SwissADME ADMET analysis and StopTox toxicity profile evaluation. - Abdur Rauf; Muhammad Umer Khan; Maha Munir; Chaudhry Ahmed Shabbir; Umer Rashid; Walaa F. Alsanie; Abdulhakeem S. Alamri; Amal F. Alshammary; Humira Naz; Rekha Thiruvengadam; Rekha Arcot; Muthu Thiruvengadam (J. Comput. Aided Mol. Des., 2026)

Discovery of potent thymidine phosphorylase inhibitors from Euphorbia pulcherrima Willd. ex Klotzsch with experimental validation and computational analysis. - Abdur Rauf; Saima Naz; Muhammad Umer Khan; Maha Munir; Zuneera Akram; Walaa F. Alsanie; Abdulhakeem S. Alamri; Amal F. Alshammary; Marcello Iriti (J. Comput. Aided Mol. Des., 2026)