Understanding Molecular Simulation: From Algorithms to Applications, second edition

Daan Frenkel and Berend Smit

From the Preface: "The book is aimed at readers who are active in computer simulation, or are planning to become so. Computer simulators are continuously confronted with questions concerning the choice of technique, because there is a bewildering variety of computational tools available. We believe that, in order to make a rational choice, a good understanding of the physics behind each technique is essential. Our aim is to provide the reader with this background."

Molecular Simulation 2012 Tutorial

Online information

Comments and remarks can be sent to Berend-Smit@Berkeley.edu.


Berend Smit
Department of Chemical Engineering and Department of Chemistry
University of California, Berkeley
101B Gilman Hall 1462
Berkeley, CA 94720-1462

Daan Frenkel
Trinity College
Lensfield Road
Cambridge, CB2 1EW
United Kingdom
Email: df246@cam.ac.uk