Web-access to atomistic molecular dynamics trajectories for relevant signal transduction proteins.
MoDEL_CNS is a platform designed to provide web-access to atomistic molecular dynamics trajectories for relevant signal transduction proteins. MoDEL_CNS expands the Molecular Dynamics Extended Library (MoDEL) database of atomistic Molecular Dynamics trajectories with proteins involved in Central Nervous System (CNS) processes, including membrane proteins. MoDEL_CNS web server interface presents the resulting trajectories, analyses, and protein properties. All data produced by the project is available to download. MoDEL_CNS will contribute to the improvement of the understanding of neuronal signalling cascades by protein structure-based simulations, calculating molecular flexibility and dynamics, and guiding systems level modelling.