| The
Center for Molecular Modeling -
http://cmm.info.nih.gov/modeling/
Several tutorials related to molecular modeling, software links. |
| Amber
- http://www.amber.ucsf.edu/amber/amber.html
A general purpose molecular mechanics and molecular dynamics package with the capability to compute free-energy changes. |
| Gaussian
Basis Set - http://www.emsl.pnl.gov:2080/forms/basisform.html
free download of many basis sets in different formats. |
| Carbohydrates
- http://www.dkfz-heidelberg.de/spec/
Offers a number of free online services; focus is on carbohydrates. |
| Molecular
Model Kits - http://www.sphere.ad.jp/hgs/model/index.html
Plastic molecular structure models for research and education in science, intended especially for biochemistry. |
| Molecular
Modelling Toolkit (MMTK) - http://starship.python.net/crew/hinsen/MMTK/
a library for molecular modelling applications. |
| Quantum
Chemistry Program Exchange (QCPE) -
http://www.osc.edu/ccl/qcpe/QCPE/index.html
catalog of available software |
| The
RCSB Protein Data Bank - http://www.rcsb.org/pdb/
A free repository of protein structures in a standard file format |
| AIMPAC
- http://www.chemistry.mcmaster.ca/aimpac/aimpac.html
software related to the Bader's Atoms in Molecules Theory |
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