Molecular dynamics simulations have become instrumental in replacing our view of proteins as relatively rigid structures with the realization that they were dyn

This volume explores the recent advancements in biomolecular simulations of proteins, small molecules, and nucleic acids, with a primary focus on classical mole

Very broad overview of the field intended for an interdisciplinary audience; Lively discussion of current challenges written in a colloquial style; Author is a

A guide to applying the power of modern simulation tools to better drug design Biomolecular Simulations in Structure-based Drug Discovery offers an up-to-date a

Computer Applications -- Physical Sciences and Engineering.