Current location: Chemistry > Computational
11. Gaussian Basis Set
Free download of many basis sets in different formats.
http://www.emsl.pnl.gov:2080/forms/basisform.html - 15-11-2003
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[detailed information]
Rating: [6.00] Votes: [2094]
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12. MatHub
Features current and background information about molecular modeling and informatics for chemistry and materials science.
http://www.mathub.com/ - 17-09-2000
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[detailed information]
Rating: [6.00] Votes: [1231]
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13. Molecular Modeling
Links to information on chemical structures, graphics, slide shows, and modeling experiments.
http://www.molecules.org/ - 07-01-2004
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[detailed information]
Rating: [6.00] Votes: [239]
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14. 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
http://origin.ch.ic.ac.uk/local/organic/mod/ - 09-01-2003
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[detailed information]
Rating: [6.00] Votes: [1477]
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15. 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 - 23-04-2000
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[detailed information]
Rating: [6.00] Votes: [2064]
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20. Computational Chemistry Toolkit
A free resource for carrying out on-line semiempirical computational chemistry calculations based on the GAMESS programm package.
http://www.chemweb.com/tools - 13-08-2002
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[detailed information]
Rating: [5.00] Votes: [276]
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