Biomolecular SIMulations Research Group
Please check our recent publication in the International Journal of Biological Macromolecules (IF 6.953), a collaborative effort of BioSIM with Univ Minho/CBMA and CEB. The milk-derived lactoferrin inhibits V-ATPase activity …
Please, check our recent publication in Molecules (IF 3.267): Identification of New Potential Inhibitors of Quorum Sensing through a Specialized Multi-Level Computational Approach Fábio G. Martins, André Melo, and Sérgio …
Please check our recently published book “The Application of Quantum Mechanics in Reactivity of Molecules”, edited by Dr. Sérgio F. Sousa. The Application of Quantum Mechanics in Reactivity of Molecules …
Please, check our recent publication in Journal of Chemical Education introducing BioSIMAR, a tool for easy interactive visualization of molecules by augmented reality developed at BioSIM/FMUP. Developing and Using BioSIMAR, an …
Please, check our recent publication in Trends in Microbiology (IF 13.546): LegionellaDB – A Database on Legionella Outbreaks Inês G. Gonçalves, Henrique S. Fernandes, Ana Melo, Sérgio F. Sousa, Lúcia C. …
Please, check our recent publication in Current Medicinal Chemistry (IF 4.184): Multifunctional Enzymes as Targets for the Treatment of Tuberculosis: Paving the Way for New Anti-TB Drugs Carla S.S. Teixeira, Nuno …
Please check our new paper published in the International Journal of Molecular Sciences (IF 4.556). This collaborative review with Dr. Pedro Gomes (Cintesis, FMUP; CIBB, Univ Coimbra) summarizes the protein …
Please check our latest paper “The Biofilms Structural Database” now available online at https://doi.org/10.1016/j.tibtech.2020.04.002 The Biofilms Structural Database Rita P. Magalhães, Tatiana F. Vieira, Henrique S. Fernandes, André Melo, Manuel Simões, …
Good news! Our collaborative review article was read enough times to be a #TopDownloadedArticle in its journal. “Analyzing PEGylation through Molecular Dynamics Simulations” https://doi.org/10.1002/slct.201800855 Thank you @ChemistrySelect Analyzing PEGylation through …
Please check out our latest review paper now available online: https://doi.org/10.1002/ijch.202000014 Modelling Enzymatic Mechanisms with QM/MM Approaches: Current Status and Future Challenges Rita P. Magalhães, Henriques S. Fernandes, and Sérgio F. …