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    ExafsArchitect

    ExafsArchitect

    A tool kit for EXAFS/XAS/XES Analysis

    ExafsArchitect helps you to create molecular models (or grids of molecular models) that allows you, by systematically varying the coordinates of ligands relevant to Chemistry and biology, to easily calculate and evaluate structural effects in EXAFS/XAS and XES spectra using FEFF and/or ORCA.
    Downloads: 1 This Week
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