This distinguished journal publishes articles concerned with all aspects of computational chemistry: analytical, biological, inorganic, organic, physical, and materials. The Journal of Computational Chemistry presents original research, contemporary developments in theory and methodology, and state-of-the-art applications. Computational areas that are featured in the journal include ab initio and semiempirical quantum mechanics, density functional theory, molecular mechanics, molecular dynamics, statistical mechanics, cheminformatics, biomolecular structure prediction, molecular design, and bioinformatics.

E d i t o r s

Charles L. Brooks III
Department of Chemistry, Biophysics Program
University of Michigan
930 North University Avenue
Ann Arbor, MI 48109 USA
Tel: 1-734-647-6682
Fax: 1-734-647-1604
E-mail: brookscl@umich.edu
 

Gernot Frenking
Fachbereich Chemie
Philipps-Universität Marburg
Hans-Meerwein-Strasse
D-35032 Marburg, Germany
Tel: 49-6421-282-5563
Fax: +49-6421-282-5566 or -8917
E-mail: frenking@chemie.uni-marburg.de

Masahiro Ehara
Research Center for Computational Science
Institute for Molecular Science
38 Nishigo-Naka, Myodaiji
Okazaki 444-8585, Japan
Tel: 81-564-55-7461
Fax: 81-564-55-7025
E-mail: ehara@ims.ac.jp
 

Peter R. Schreiner
Institute of Organic Chemistry
Justus-Liebig University Giessen
Heinrich-Buff-Ring 58
D-35392 Giessen, Germany
Tel: +49-641-9934-300
Fax: +49-641-9934-309
E-mail: jcc@org.chemie.uni-giessen.de

E d i t o r s   E m e r i t i

Norman L. Allinger
University of Georgia, USA

Paul von R. Schleyer
University of Georgia, USA


E d i t o r i a l   A d v i s o r y   B o a r d

Yitzhak Apeloig
Technion-Israel Institute of Technology, Israel
E-mail: chrapel@techunix.technion.ac.il


Evert J. Baerends
Vrije Universiteit, The Netherlands
E-mail: baerends@chem.vu.nl


Vincenzo Barone
Scuola Normale Superiore, Italy
E-mail: vincenzo.barone@sns.it


F. Matthias Bickelhaupt
VU University Amsterdam, The Netherlands
E-mail: F.M.Bickelhaupt@vu.nl


Peter Carsky
Academy of Sciences of the Czech Republic, Czech Republic
E-mail: petr.carsky@jh-inst.cas.cz


David Case
Rutgers University, USA
E-mail: case@biomaps.rutgers.edu


Richard A. Friesner
Columbia University, USA
E-mail: rich@chem.columbia.edu


Stefan Grimme
University of Bonn, Germany
E-mail: grimme@thch.uni-bonn.de


Teresa L. Head-Gordon
University of California Berkeley, USA
E-mail: TLHead-Gordon@lbl.gov


Kimihiko Hirao
RIKEN, Japan
E-mail: hirao@riken.jp


Ken Houk
University of California Los Angeles, USA
E-mail: houk@chem.ucla.edu


Toshiko Ichiye
Georgetown University, USA
E-mail: ti9@georgetown.edu


Eluvathingal D. Jemmis
Indian Institute of Science, Bangalore, India
E-mail: jemmis@ipc.iisc.ernet.in


Martin Karplus
Harvard University, USA
E-mail: marci@tammy.harvard.edu


Kwang Kim
Pohang University of Science and Technology, Republic of Korea
E-mail: kim@postech.ac.kr


Ronnie Kosloff
Hebrew University, Israel
E-mail: ronnie@fh.huji.ac.il


Elfi Kraka
Southern Methodist University, USA
E-mail: ekraka@smu.edu


Richard Lavery
Institut de Biologie Physico-Chimique, France
E-mail: rlavery@ibpc.fr


Alexander MacKerell
University of Maryland, USA
E-mail: amackere@rx.umaryland.edu

Nancy Makri
University of Illinois, USA
E-mail: nancy@makri.scs.uiuc.edu


Keiji Morokuma
Kyoto University, Japan
E-mail: morokuma@fukui.kyoto-u.ac.jp


Shigeru Nagase
Institute for Molecular Science, Japan
E-mail: nagase@ims.ac.jp


Kevin Naidoo
University of Cape Town, South Africa
E-mail: kevin.naidoo@uct.ac.za


Modesto Orozco
Universitat de Barcelona, Spain
E-mail: modesto.orozco@irbbarcelona.org


Peter Pulay
University of Arkansas, USA
E-mail: pulay@uark.edu


Leo Radom
University of Sydney, Australia
E-mail: leo.radom@sydney.edu.au


Krishnan Raghavachari
Indiana University, USA
E-mail: Kraghava@indiana.edu


Graham Richards
University of Oxford, UK
E-mail: graham.richards@chem.ox.ac.uk


Benoit Roux
University of Chicago, USA
E-mail: roux@uchicago.edu


Dennis Salahub
University of Calgary, Canada
E-mail: dennis.salahub@ucalgary.ca


Harold A. Scheraga
Cornell University, USA
E-mail: has5@cornell.edu


H. Bernhard Schlegel
Wayne State University, USA
E-mail: hbs@chem.wayne.edu


Peter Schwerdtfeger
Massey University Albany, New Zealand
E-mail: p.a.schwerdtfeger@massey.ac.nz


Sason Shaik
Hebrew University, Israel
E-mail: sason@yfaat.ch.huji.ac.il


Walter Thiel
Max-Planck-Insitut für Kohlenforschung, Germany
E-mail: thiel@mpi-muelheim.mpg.de


Wilfred F. van Gunsteren
ETH Zurich, Switzerland
E-mail: wfvgn@igc.phys.chem.ethz.ch


Kenneth B. Wiberg
Yale University, USA
E-mail: kenneth.wiberg@yale.edu


Yun-Dong Wu
Hong Kong University of Science and Technology, Hong Kong
E-mail: chydwu@ust.hk

H o n o r a r y   E d i t o r i a l   B o a r d

Enrico Clementi
University L. Pasteur, France


Alberte Pullman
Institut de Biologie Physico-Chimique, France


Andrew Streitwieser, Jr.
University of California Berkeley, USA