Integrating machine learning and molecular simulations for the design of potent HDAC2 inhibitors in diffuse large B-cell lymphoma. - Josiah Joseph Isah; Adamu Uzairu; Sani Uba; Muhammad Tukur Ibrahim (Comput. Biol. Chem., 2026)

From scaffold to candidate: an integrated machine Learning, QSAR, docking, and molecular dynamics framework for the rational design of IRAK4 inhibitors in diffuse large B-cell lymphoma. - Josiah Joseph Isah; Adamu Uzairu; Sani Uba; Muhammad Tukur Ibrahim (Netw. Model. Anal. Health Informatics Bioinform., 2026)