University of Minnesota
University of Minnesota
http://www.umn.edu/
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College of Science and Engineering > Department of Chemistry

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AMSOL

AMSOL is our semiempirical program for calculating the properties of molecules in solution. You can find out more information on the AMSOL homepage.

 

GAMESSPLUS

On the GAMESSPLUS homepage you can obtain modules that, when added to the free electronic strucure program GAMESS, allow for the inclusion of solvation effects at the ab initio and density functional SCRF levels. The HONDOPLUS homepage provides details on analogous free, stand-alone code having the same functionality.

 

MN-GSM

More information on similar modules available for the Gaussian series of programs can be found on the MN-GSM homepage.

 

OMNISOL

OMNISOL is a free (but licensed) program for the rapid (non-quantum-mechanical) estimation of solvation free energies in water or organic solvents. For more information see the OMNISOL homepage.

 

For a complete comparison of available codes and solvation modules, see http://comp.chem.umn.edu/solvation/comparison.htm.