Pedro Alexandrino Fernandes

Research interests

Publications

• The chemistry of snake venom and its medicinal potential

  Nature Reviews Chemistry · 2022 · https://doi.org/10.1038/s41570-022-00393-7

• Glossary of terms used in physical organic chemistry (IUPAC Recommendations 2021)

  Pure and Applied Chemistry · 2022 · https://doi.org/10.1515/pac-2018-1010

• α-Glucosidase inhibition by flavonoids: an in vitro and in silico structure–activity relationship study

  Journal of Enzyme Inhibition and Medicinal Chemistry · 2017 · https://doi.org/10.1080/14756366.2017.1368503

• Cholesterol Biosynthesis: A Mechanistic Overview

  Biochemistry · 2016 · https://doi.org/10.1021/acs.biochem.6b00342

• Application of quantum mechanics/molecular mechanics methods in the study of enzymatic reaction mechanisms

  Wiley Interdisciplinary Reviews Computational Molecular Science · 2016 · https://doi.org/10.1002/wcms.1281

• Protein-Ligand Docking in the New Millennium – A Retrospective of 10 Years in the Field

  Current Medicinal Chemistry · 2013 · https://doi.org/10.2174/0929867311320180002

• Hot spots—A review of the protein–protein interface determinant amino‐acid residues

  Proteins Structure Function and Bioinformatics · 2007 · https://doi.org/10.1002/prot.21396

• General Performance of Density Functionals

  The Journal of Physical Chemistry A · 2007 · https://doi.org/10.1021/jp0734474

• Computational alanine scanning mutagenesis—An improved methodological approach

  Journal of Computational Chemistry · 2006 · https://doi.org/10.1002/jcc.20566

• Protein–ligand docking: Current status and future challenges

  Proteins Structure Function and Bioinformatics · 2006 · https://doi.org/10.1002/prot.21082

• Theoretical Insights into the Mechanism for Thiol/Disulfide Exchange

  Chemistry - A European Journal · 2003 · https://doi.org/10.1002/chem.200305343

Current projects

No projects listed.