The calculation of rate coefficients is a discipline of nonlinear science of importance to much
of physics, chemistry, engineering, and biology. Fifty years after Kramers' seminal paper on …

During recent decades it has become feasible to simulate the dynamics of molecular
systems on a computer. The method of molecular dynamics (MD) solves Newton's equations …

Amber is the collective name for a suite of programs that allow users to carry out molecular
dynamics simulations, particularly on biomolecules. None of the individual programs carries …

This graduate-level introduction to the theory and applications of time correlation functions
and the molecular theory of fluid dynamics provides experimentalists with the theoretical …

From the Preface:" The purpose of this book is to present and apply a language and to
discuss methods which make it very convenient to exploit such analogies, and which are …

This volume of" Water-A Comprehensive Treatise" is devoted to aqueous solutions of
macromolecules and aqueous systems of small molecules which exhibit reversible …

The general subject of colored noise driven dynamical flows is rooted in the study of the
motion of small particles suspended in a fluid and moving under the influence of random …

Presenting a wide-ranging view of current developments in protein research, the papers in
this collection, each written by highly regarded experts in the field, examine various aspects …

The semiclassical (SC) initial value representation (IVR) provides a potentially practical way
for adding quantum mechanical effects to classical molecular dynamics (MD) simulations of …

This textbook offers an introduction to the foundations of spectroscopic methods and
provides a bridge between basic concepts and experimental applications in fields as diverse …