The computational molecular sciences utilize the techniques of rigorous chemical as well as physical theories and computer-based modeling, relying on specialized hardware and software development, algorithm design, and database management to examine and elucidate all aspects of the molecular sciences. These approaches bridge chemistry, biology, and the materials sciences and have connections to neighboring chemical as well as biological application-driven fields. WIREs Computational Molecular Science will review and highlight research from all these fields..

Editorial & Advisory Board
Editor in Chief
Peter R. Schreiner	Justus-Liebig University Giessen

Editorial Board
Walter Thiel	Max-Planck-Institut für Kohlenforschung
Modesto Orozco	IRB Barcelona
Jinlong Yang	University of Science & Technology of China
Edward Valeev	Virginia Tech
Raghavan B. Sunoj	Indian Institute of Technology Bombay
Clémence Corminboeuf	Ecole polytechnique fédérale de Lausanne

International Advisory Board
Alejandro Toro-Labbé	Pontificia Universidad Catolica de Chile, Chile
Anna Krylov	University of Southern California, USA
Clémence Corminboeuf	Laboratory for Computational Molecular Design, Switzerland
David C. Clary	University of Oxford, UK
Eluvathingal D. Jemmis	Indian Institute of Science Education and Research, India
Jiali Gao	University of Minnesota, USA
Jürgen Gauss	Johannes Gutenberg-Universität Mainz, Germany
Kendall N. Houk	University of California, Los Angelses, USA
Kwang Soo Kim	Pohang University of Science and Technology, Republic of Korea
Leo Radom	The University of Sydney, Australia
Matthias Rarey	Universität Hamburg, Germany
Peter Schwerdtfeger	Massey University, New Zealand
Rigoberto Hernandez	Georgia Institute of Technology, USA
Robert C. Glen	University of Cambridge, UK
Sason Shaik	The Hebrew University, Israel
Stefan Grimme	Universität Münster, Germany
Trygve Helgaker	University of Oslo, Norway
Yundong Wu	Hong Kong University of Science and Technology, Hong Kong
Zhigang Shuai	Tsinghua University, China