Biomolecular SIMulations Research Group
Our first paper on the study of SARS-CoV-2 is finally out. This study developed at BioSIM (UCIBIO@REQUIMTE – Faculdade de Medicina, Universidade do Porto) and at University of Bordeaux and University of Nantes was published in Viruses (IF …
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 Applied Science (IF 2.474): The Application of Quantum Mechanics in Reactivity of Molecules Sérgio F. Sousa DOI: 10.3390/app11031132 | Applied Sciences Over the last few …
Please, check our recent publication in ChemPhysChem (IF 3.144): An Unsual Cys‐Glu‐Lys Catalytic Triad is Responsible for the Catalytic Mechanism of the Nitrilase Superfamily: a QM/MM study on Nit2 Carla S. …
Please, check our recent publication in Biofouling (IF 2.847): Databases for the Study of Biofilms: Current Status and Potential applications Fábio G. Martins, André Melo, and Sérgio F. Sousa DOI: 10.1080/08927014.2021.1876849 | Biofouling Biofilms play an …
Please, check our recent publication on the inhibition of SARS-CoV-2 developed at BioSIM in collaboration with the University of Bordeaux and University of Nantes, already available at bioRxiv: In silico, …
Sérgio F. Sousa (BioSIM) presented a seminar entitled “Computational Biochemistry Approaches in the Study of the Biophysics of Proteins and Enzymes” last Tuesday, January 5th , 2021. This seminar was part …
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 recent publication in Chemical Biology & Drug Design (IF 4.831), a collaboration with Prof. Lígia Rodrigues lab (Univ. Minho): Selection of a New peptide homing SK‐BR‐3 breast cancer …
Please, check our recent publication in Bioorganic Chemistry (IF 4.831): Combined In Silico and In Vitro Studies to Identify Novel Antidiabetic Flavonoids Targeting Glycogen Phosphorylase Natércia F. Brás, Rui P.P. Neves, …