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Biochemical simulations

Methionine Sulfoxides on Prion Protein Helix-3 Switch on the α-Fold Destabilization Required for Conversion

Giorgio Colombo, Massimiliano Meli, [ ... ], María Gasset

Similarity Measures for Protein Ensembles

Kresten Lindorff-Larsen, Jesper Ferkinghoff-Borg

Inhibition of α-Synuclein Fibrillization by Dopamine Is Mediated by Interactions with Five C-Terminal Residues and with E83 in the NAC Region

Fernando E. Herrera, Alessandra Chesi, [ ... ], Paolo Carloni

Mechanisms of Hybrid Oligomer Formation in the Pathogenesis of Combined Alzheimer's and Parkinson's Diseases

Igor F. Tsigelny, Leslie Crews, [ ... ], Eliezer Masliah

High Protein Binding and Cidal Activity against Penicillin-Resistant S. pneumoniae: A Cefditoren In Vitro Pharmacodynamic Simulation

David Sevillano, Lorenzo Aguilar, [ ... ], José Prieto

Finite Size Effects in Simulations of Protein Aggregation

Amol Pawar, Giorgio Favrin

A Fully Atomistic Model of the Cx32 Connexon

Sergio Pantano, Francesco Zonta, Fabio Mammano

Model for the Peptide-Free Conformation of Class II MHC Proteins

Corrie A. Painter, Anthony Cruz, [ ... ], Zarixia Zavala-Ruiz

Fibronectin Unfolding Revisited: Modeling Cell Traction-Mediated Unfolding of the Tenth Type-III Repeat

Elaine P. S. Gee, Donald E. Ingber, Collin M. Stultz

SP⁵: Improving Protein Fold Recognition by Using Torsion Angle Profiles and Profile-Based Gap Penalty Model

Wei Zhang, Song Liu, Yaoqi Zhou

Hierarchical Effector Protein Transport by the Salmonella Typhimurium SPI-1 Type III Secretion System

Brit Winnen, Markus C. Schlumberger, [ ... ], Wolf-Dietrich Hardt

Implications from a Network-Based Topological Analysis of Ubiquitin Unfolding Simulations

Arun Krishnan, Alessandro Giuliani, Joseph P. Zbilut, Masaru Tomita

Calmodulin Activation by Calcium Transients in the Postsynaptic Density of Dendritic Spines

Daniel X. Keller, Kevin M. Franks, Thomas M. Bartol Jr, Terrence J. Sejnowski

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