Journal of Biomolecular Structure and Dynamics Elucidating the binding mechanisms of GABA and Muscimol as an avenue to discover novel GABA-mimetic small molecules. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Identification of β-cycloidal-derived mono-carbonyl curcumin analogs as potential interleukin-6 inhibitor to treat wound healing through QSAR, molecular docking, MD simulation, MM-GBSA calculation. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Identification of β-cycloidal-derived mono-carbonyl curcumin analogs as potential interleukin-6 inhibitor to treat wound healing through QSAR, molecular docking, MD simulation, MM-GBSA calculation. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Identification of β-cycloidal-derived mono-carbonyl curcumin analogs as potential interleukin-6 inhibitor to treat wound healing through QSAR, molecular docking, MD simulation, MM-GBSA calculation. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Conformational analysis of lipid membrane mimetics modified with Aβ42 peptide by Raman spectroscopy and computer simulations. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Discovery of small molecule entry inhibitors targeting the linoleic acid binding pocket of SARS-CoV-2 spike protein. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Mapping the APOE structurally on missense variants in elderly Brazilians. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Mitoxantrone 2HCl’s adroit activity against cervical cancer replication and maintenance proteins: a multitargeted approach. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Computer-aided drug discovery of c-Abl kinase inhibitors from plant compounds against chronic myeloid leukemia. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Electric field induced the changes in structure and function of human transforming growth factor beta receptor type I: from molecular dynamics to docking. By , 8 months ago