His primary areas of investigation include Metadynamics, Computational chemistry, Molecular dynamics, Statistical physics and Protein structure. His research in Metadynamics intersects with topics in Collective variables, Docking and Protein folding. His work deals with themes such as Biomolecule, Potential energy surface, Time evolution and Closed conformation, which intersect with Computational chemistry.
Francesco Luigi Gervasio has included themes like Crystallography, Car–Parrinello molecular dynamics, Chemical physics and Systems biology in his Molecular dynamics study. His Statistical physics study incorporates themes from Phase transition, Umbrella sampling and Local Elevation. His biological study spans a wide range of topics, including Biophysics, Stereochemistry and Protein secondary structure.
The scientist’s investigation covers issues in Metadynamics, Molecular dynamics, Biophysics, Allosteric regulation and Computational chemistry. His Metadynamics research is multidisciplinary, relying on both Chemical physics, Statistical physics, Docking and Collective variables. His studies in Statistical physics integrate themes in fields like Protein folding and Local Elevation.
His Molecular dynamics research incorporates elements of Plasma protein binding, Ab initio, Hydrogen bond, Protein structure and Binding site. His study in Biophysics is interdisciplinary in nature, drawing from both Amino acid, Nanotechnology, Kinase and Phosphorylation. His study on Allosteric regulation also encompasses disciplines like
Francesco Luigi Gervasio spends much of his time researching Biophysics, Allosteric regulation, Cell biology, Molecular dynamics and Enzyme. His studies deal with areas such as Agonist, Intracellular, G protein and Ternary complex as well as Biophysics. Francesco Luigi Gervasio focuses mostly in the field of Allosteric regulation, narrowing it down to topics relating to G protein-coupled receptor and, in certain cases, Structural similarity, Binding pocket, Adenosine receptor and Ligand.
His Cell biology research integrates issues from Mode of action and Energy landscape. Specifically, his work in Molecular dynamics is concerned with the study of Metadynamics. In general Enzyme, his work in Active site is often linked to β lactamases and Shape change linking many areas of study.
His scientific interests lie mostly in Molecular dynamics, Computational biology, Binding site, Metadynamics and State model. The Molecular dynamics study combines topics in areas such as Statistical physics, Observable and Pathogenic mutation. The concepts of his Computational biology study are interwoven with issues in G protein-coupled receptor, Ligand, Adenosine receptor, Binding pocket and Selectivity.
He combines subjects such as Protein dynamics and Drug discovery with his study of Binding site.
This overview was generated by a machine learning system which analysed the scientist’s body of work. If you have any feedback, you can contact us here.
Metadynamics: a method to simulate rare events and reconstruct the free energy in biophysics, chemistry and material science
Alessandro Laio;Francesco L Gervasio.
Reports on Progress in Physics (2008)
From A to B in free energy space.
Davide Branduardi;Francesco Luigi Gervasio;Michele Parrinello.
Journal of Chemical Physics (2007)
Assessing the accuracy of metadynamics.
Alessandro Laio;Antonio Rodriguez-Fortea;Francesco Luigi Gervasio;Matteo Ceccarelli.
Journal of Physical Chemistry B (2005)
Efficient reconstruction of complex free energy landscapes by multiple walkers metadynamics.
Paolo Raiteri;Alessandro Laio;Francesco Luigi Gervasio;Cristian Micheletti.
Journal of Physical Chemistry B (2006)
Free-Energy Landscape for β Hairpin Folding from Combined Parallel Tempering and Metadynamics
Giovanni Bussi;Francesco Luigi Gervasio;and Alessandro Laio;Michele Parrinello.
Journal of the American Chemical Society (2006)
Promoting transparency and reproducibility in enhanced molecular simulations
M. Bonomi;M. Bonomi;B. Giovanni;C. Camilloni;G.A. Tribello.
Nature Methods (2019)
Flexible Docking in Solution Using Metadynamics
Francesco Luigi Gervasio;and Alessandro Laio;Michele Parrinello.
Journal of the American Chemical Society (2005)
Stacking and T-shape competition in aromatic-aromatic amino acid interactions.
Riccardo Chelli;Francesco Luigi Gervasio;Piero Procacci;Vincenzo Schettino.
Journal of the American Chemical Society (2002)
The Role of Protein Loops and Linkers in Conformational Dynamics and Allostery.
Elena Papaleo;Giorgio Saladino;Matteo Lambrughi;Kresten Lindorff-Larsen.
Chemical Reviews (2016)
Molecular basis of cyclooxygenase enzymes (COXs) selective inhibition
Vittorio Limongelli;Massimiliano Bonomi;Luciana Marinelli;Francesco Luigi Gervasio.
Proceedings of the National Academy of Sciences of the United States of America (2010)
If you think any of the details on this page are incorrect, let us know.
We appreciate your kind effort to assist us to improve this page, it would be helpful providing us with as much detail as possible in the text box below: