28 citations · 38 across the 4 of their papers we have counts for
4 papers
NLRP3 monomer Functional Dynamics: from the Effects of Allosteric Binding to Implications for Drug Design
Emanuele Casali, Stefano A. Serapian, Eleonora Gianquinto +4
The protein NLRP3 and its complexes are associated with an array of inflammatory pathologies, among which neurodegenerative, autoimmune, and metabolic diseases. Targeting the NLRP3…
Study of the Villin Headpiece folding dynamics by combining coarse-grained Monte Carlo evolution and all-atom Molecular Dynamics
Giacomo M. S. De Mori, Giorgio Colombo, Cristian Micheletti
The folding mechanism of the Villin headpiece (HP36) is studied by means of a novel approach which entails an initial coarse-grained Monte Carlo (MC) scheme followed by all-atom mo…
Thermodynamics of beta-amyloid fibril formation
G. Tiana, F. Simona, R. A. Broglia +1
Amyloid fibers are aggregates of proteins. They are built out of a peptide called --amyloid (A) containing between 41 and 43 residues, produced by the action of an enzyme whi…
Understanding the determinants of stability and folding of small globular proteins from their energetics
G. Tiana, F. Simona, G. M. S. De Mori +2
The results of minimal model calculations suggest that the stability and the kinetic accessibility of the native state of small globular proteins are controlled by few "hot" sites.…