Deciphering the mechanism of resistance by novel double mutations in pncA in Mycobacterium tuberculosis using protein structural graphs (PSG) and structural bioinformatic approaches. - Fahad M. Alshabrmi; Eid A. Alatawi (Comput. Biol. Medicine, 2023)

Structure-based design of promising natural products to inhibit thymidylate kinase from Monkeypox virus and validation using free energy calculations. - Abbas Khan; Shoaib Adil; Hafiza Ayesha Qudsia; Yasir Waheed; Fahad M. Alshabrmi; Dong-Qing Wei (Comput. Biol. Medicine, 2023)

Role of small molecules as drug candidates for reprogramming somatic cells into induced pluripotent stem cells: A comprehensive review. - Abdur Rehman; Israr Fatima; Fatima Noor; Muhammad Qasim; Peng Wang; Jinrui Jia; Fahad M. Alshabrmi; Mingzhi Liao (Comput. Biol. Medicine, 2024)

Immunoinformatics-driven In silico vaccine design for Nipah virus (NPV): Integrating machine learning and computational epitope prediction. - Muhammad Shahab; Muhammad Waleed Iqbal; Abbas Ahmad; Fahad M. Alshabrmi; Dong-Qing Wei; Abbas Khan; Guojun Zheng (Comput. Biol. Medicine, 2024)

Multi-Omics Analysis of the virulence factors and designing of next-generation multi-epitopes Vaccines against Rickettsia prowazekii: a computer-aided vaccine designing approach. - Fahad M. Alshabrmi (J. Comput. Aided Mol. Des., 2025)

Phenolic-based allosteric inhibition of PTP1B: unlocking new therapeutic potential for metabolic disorders. - Emadeldin M. Kamel; Ahmed A. Allam; Hassan A. Rudayni; Fahad M. Alshabrmi; Faris F. Aba Alkhayl; Al Mokhtar Lamsabhi (J. Comput. Aided Mol. Des., 2025)