Molecular Dynamics, Trajectory and Ensemble Analysis on Vecura
Proteins move, and a single structure does not capture that. Vecura provides five related operations for working with protein dynamics: running physics-based simulations, analysing existing trajectories, generating trajectories with learned models, analysing conformational ensembles, and generating ensembles from sequence. Together they support biophysical characterisation, ensemble-based docking, binding kinetics and conformational landscape exploration. The five operations differ mainly in what you start from and how much physical accuracy you need. The selection table below is the fastest route to the right one.