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Showing 3 open source projects for "cas"

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    EPLF

    EPLF

    Electron Pair Localization Function

    The Electron Pair Localization Function (EPLF) helps to understand chemical bonding in molecular systems. This code uses a modified formulation which allows the exact calculation of the EPLF for usual wave functions (HF,KS,CAS,...)
    Downloads: 0 This Week
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  • 2
    This application transcribes basic codons and tells you the amino acid it codes for, the tRNA anti-Codon, and give you a 3D structural model of the amino acid and 2D picture of its chemical structure. Analysis reports can then be printed by the user.
    Downloads: 0 This Week
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  • 3
    ChemM is a free chemical manager for storing and searching information about reagents in laboratory. Allows substructure/exac matching as well as searching by name/cas numbers/reagent codes.
    Downloads: 0 This Week
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