https://www.selleckchem.com/pr....oducts/selonsertib-g
© 2020 Elsevier Inc. All rights reserved.Molecular dynamics (MD) studies of biomolecules require the ability to simulate complex biochemical systems with an increasingly larger number of particles and for longer time scales, a problem that cannot be overcome by computational hardware advances alone. A main problem springs from the intrinsically high-dimensional and complex nature of the underlying free energy landscape of most systems, and from the necessity to sample accurately such landscapes for identifying kinetic and th