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Journal of Biomolecular Structure & Dynamics|February 2, 2021
Impact of dimerization and N3 binding on molecular dynamics of SARS-CoV and SARS-CoV-2 main proteasesMustafa Tekpinar, Ahmet YildirimJournal of Biomolecular Structure & Dynamics|February 2, 2021
Insight into the binding mechanism of macrolide antibiotic; erythromycin to calf thymus DNA by multispectroscopic and computational approachesNahid Shahabadi, Mahtab RazlansariJournal of Biomolecular Structure & Dynamics|February 3, 2021
Identification of novel anti-cancer agents, applying in silico method for SENP1 protease inhibitionSomayye Taghvaei, Farzaneh Sabouni, Zarrin Minuchehr, et al.Journal of Biomolecular Structure & Dynamics|December 16, 2021
Computational investigation of potent inhibitors against YsxC: structure-based pharmacophore modeling, molecular docking, molecular dynamics, and binding free energyReena Kumari, Ravi Rathi, Seema R Pathak, et al.Journal of Biomolecular Structure & Dynamics|December 16, 2021
An insight into SARS-CoV-2 membrane protein interaction with spike, envelope, and nucleocapsid proteinsPrateek Kumar, Amit Kumar, Neha Garg, et al.Journal of Biomolecular Structure & Dynamics|December 17, 2021
Olive oil-based quercetin nanoemulsion (QuNE)'s interactions with human serum proteins (HSA and HTF) and its anticancer activityFarnaz Ahmadi Oskooei, Jamshid Mehrzad, Ahmad Asoodeh, et al.Journal of Biomolecular Structure & Dynamics|December 20, 2021
Structural and functional insight into thiazolidinone derivatives as novel candidates for anticancer drug design: in vitro biological and in-silico strategiesPervaiz Ali Channar, Mubashir Aziz, Syeda Abida Ejaz, et al.Journal of Biomolecular Structure & Dynamics|November 25, 2021
In silico structural analysis of secretory clusterin to assess pathogenicity of mutations identified in the evolutionarily conserved regionsLipi Das, Shashank Shekhar, Pratik Chandrani, et al.Journal of Biomolecular Structure & Dynamics|November 25, 2021
In silico screening and covalent binding of phytochemicals of Ocimum sanctum against SARS-CoV-2 (COVID 19) main proteasePranab Kishor Mohapatra, Kumar Sambhav Chopdar, Ganesh Chandra Dash, et al.Journal of Biomolecular Structure & Dynamics|January 11, 2022
Cytotoxic and apoptotic effects of some (R)-carvone-isoxazoline derivatives on human fibrosarcoma and carcinoma cells: experimental evaluation for cytotoxicity, molecular docking and molecular dynamics studiesAli Oubella, Abdoullah Bimoussa, Said Byadi, et al.Pageof 935