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scm.com - ADF: Density Functional Theory (DFT) software for chemists
ADF: Density Functional Theory (DFT) software for chemists
descrizione: ADF: Accurate, efficient, user-friendly DFT software. Expert support. Strong in spectroscopy, heavy elements, chemical analysis. Free trial for ADF modeling suite including BAND, DFTB, MOPAC2012, ReaxFF, COSMO-RS
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Lingua: English
Argomenti sito:  chemistry
CHEMKED - Chemical Kinetics of Gas Phase Reactions - Databases and Simulation
mark.jelezniak.de - 

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User-friendly software uses gamess/gaussian outputs to build molecular orbital energy-level diagrams, UV/VIS spectra, density maps and prepare them for publication
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OpenEye Scientific Software develops software for drug design, molecular modeling, virtual screening and lead-hopping. Areas of expertise include cheminformatics <strong>...strong>
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3.0 / 5.0, Lingua: English
"Yet Another extended Huckel Molecular Orbital Package". Performs calculations and visualization for both molecular and extended materials in 1, 2, or 3 dimensions <strong>...strong>
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3.0 / 5.0, Lingua: English
Site critical of Gaussian, Inc.'s licensing practices. Reports allegations of Gaussian banning "competitors" from using their product.
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ChemSW is a provider of chemical inventory managment systems and program software, MSDS systems and chemistry laboratory software.
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Open source program package for calculation of thermodynamic functions from molecular data.
openthermo.wiki.sourceforge.net - 

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3.0 / 5.0, Lingua: English
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