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L-shaped distribution of the relative substitution rate (c/μ) observed for SARS-COV-2's genome, inconsistent with the selectionist theory, the neutral theory and the nearly neutral theory but a near-neutral balanced selection theory: Implication on "neutralist-selectionist" debate.
Comput Biol Med. 2023 Feb;153:106522. doi: 10.1016/j.compbiomed.2022.106522. Epub 2023 Jan 5.
Comput Biol Med. 2023.
PMID: 36638615
Free PMC article.
Binding of a positive allosteric modulator CDPPB to metabotropic glutamate receptor type 5 (mGluR5) probed by all-atom molecular dynamics simulations.
Uba AI, Chea J, Hoag H, Hryb M, Bui-Linh C, Wu C.
Uba AI, et al. Among authors: hryb m.
Life Sci. 2022 Nov 15;309:121014. doi: 10.1016/j.lfs.2022.121014. Epub 2022 Sep 28.
Life Sci. 2022.
PMID: 36179814
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Discovery of novel inhibitors of histone deacetylase 6: Structure-based virtual screening, molecular dynamics simulation, enzyme inhibition and cell viability assays.
Uba AI, Hryb M, Singh M, Bui-Linh C, Tran A, Atienza J, Misbah S, Mou X, Wu C.
Uba AI, et al. Among authors: hryb m.
Life Sci. 2024 Feb 1;338:122395. doi: 10.1016/j.lfs.2023.122395. Epub 2024 Jan 3.
Life Sci. 2024.
PMID: 38181853
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