GaussSum 3.0.2 FREE GaussSum parses the output of ADF, GAMESS, GAMESS-UK, and Gaussian to extract useful information: progress of geometry optimisation, UV/IR/Raman spectra, MO contributions and more. Features Convolute UV-Vis spectrum IR Download Rating:
Open Babel 2.4.1 FREE Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It's an open, collaborative project allowing anyone to search, convert, analyze, or store data from molecular modeling, chemistry,... Download Rating:
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