Merz Research Group The Merz research group strives to understand the relationships between structure and function of biomolecules from a quantum mechanical standpoint. http://merz.chem.psu.edu/

Australian Computational Chemistry Via the Internet Project A set of web-based teaching modules. http://www.chem.swin.edu.au/

Computational Chemistry List A resource for computational chemists. Discussions on chemistry software, data, conferences, jobs, quantum chemistry, molecular mechanics, molecular dynamics, QSAR, molecular graphics, molecular modeling, and associated archives http://www.ccl.net/chemistry/

First Principles Research, Inc. Research Theorists in Physics and Chemistry. http://www.firstprinciples.com

ACS Division of Computers in Chemistry A unit of the American Chemical Society. Includes newsletters, programs of past and future division meetings, and information on awards presented by the division. http://membership.acs.org/C/COMP/

AIChE Computational Molecular Science and Engineering Forum A unit of the American Institute of Chemical Engineers. Includes a listing of academic researchers and information on conferences sponsored or co-sponsored by the forum. http://www.ecs.umass.edu/che/am3/AIChE.html

Quantum Simulations of Complex Many-Body Systems: Lecture Notes From a 2002 conference sponsored by the John von Neumann Institute for Computing. http://www.fz-juelich.de/nic-series/volume10/volume10.html

Quantum Simulations of Complex Many-Body Systems: Poster Presentations From a 2002 conference sponsored by the John von Neumann Institute of Computing. http://www.fz-juelich.de/nic-series/volume11/volume11.html

Relativistic Theory of Atoms and Molecules Searchable database of journal articles focusing largely (but not exclusively) on relativistic ab initio quantum chemical calculations. http://www.csc.fi/rtam/

CMM Center for Molecular Modeling: Several tutorials related to molecular modeling, directory of software and links to databases. http://cmm.info.nih.gov/modeling/

Computational Chemistry Resources Directory of links related to computational chemistry. Offers several tutorials for understanding the basics of molecular structure and molecular modeling techniques. http://www.chem.swin.edu.au/chem_ref.html

Drug Design Laboratory, Milan University Molecular modeling resources, software and projects. Home of the programs Vega and BioDock. http://users.unimi.it/~ddl/

MathMol Provides students, teachers and researchers the basic concepts in mathematics and their connection to molecular modeling. Links to Software, 3D libraries and tutorials. http://www.nyu.edu/pages/mathmol/

MatHub Features current and background information about molecular modeling and informatics for chemistry and materials science. http://www.mathub.com/

Molecular Modeling Links to information on chemical structures, graphics, slide shows, and modeling experiments. http://www.molecules.org/

Molecular Modeling for Organic Chemistry Summary of lecture course which aims to introduce the hierarchy of computational modeling methods used in Organic Chemistry. Links to background and supplemental information. http://origin.ch.ic.ac.uk/local/organic/mod/

Molecular Modeling Group (RSC) One of the Specialist Interest Groups of the Royal Society of Chemistry. Links to research groups, meeting reports, software archives, selected articles. http://www.rsc.org/lap/rsccom/dab/ind006.htm

Particle-Surface Resources on the Internet Contrary to the title, also contains links to general molecular dynamics resources. http://chaos.fullerton.edu/mhslinks.html

Molecular Modeling Heidelberg Offers a number of free online services; focus is on carbohydrates. http://www.dkfz-heidelberg.de/spec/

Molecular Dynamics Contains an excellent primer for molecular dynamics with examples in Fortran, as well as some links. http://www.fisica.uniud.it/~ercolessi/md/