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Viruses|July 29, 2023
In Silico Substrate-Binding Profiling for SARS-CoV-2 Main Protease (M<sup>pro</sup>) Using Hexapeptide SubstratesSophakama Zabo, Kevin Alan LobbMolecules (Basel, Switzerland)|March 10, 2022
New Insights into the (A)Synchronicity of Diels-Alder Reactions: A Theoretical Study Based on the Reaction Force Analysis and Atomic Resolution of Energy DerivativesBienfait Kabuyaya Isamura, Kevin Alan LobbMolecules (Basel, Switzerland)|December 11, 2022
Insights into the Dynamics and Binding of Two Polyprotein Substrate Cleavage Points in the Context of the SARS-CoV-2 Main and Papain-like ProteasesZainab Kemi Sanusi, Kevin Alan LobbJournal of Molecular Modeling|September 22, 2022
A multiscale ONIOM study of the buckminsterfullerene (C<sub>60</sub>) Diels-Alder reaction: from model design to reaction path analysisBienfait Kabuyaya Isamura, Kevin Alan LobbCurrent Computer-Aided Drug Design|April 20, 2026
Comparative Structural and Functional Analysis of Plasmodium Type II Nicotinamide Adenine Dinucleotide: Quinone Oxidoreductase and its Human Homologue, Apoptosis-Inducing Factor, Mitochondrion-associated 1 (AIF-M1)Bertha Cinthia Baye, Vuyani Moses, Samuel Chima Ugbaja, et al.Pageof 1