Showing 2 open source projects for "manual testing"

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  • 1

    ParamIT

    a Toolset for Molecular Mechanical Force Field Parameterization

    ... of molecule-water complexes with graphical user interface (GUI), 2) semi-automatic frequency analysis using symbolic potential energy distribution matrix and comparison of optimized internal coordinates, 3) GUI for charge fitting with three modes: manual, Monte-Carlo sampling or brute force, and 4) GUI for dihedral terms fitting. The usage of these tools decreases the labor effort, lowers manual input errors and reduces the time needed for accurate MM parameterization efforts.
    Downloads: 0 This Week
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  • 2

    IQuant

    A pipeline for quantitative proteomics based upon isobaric tags

    ...-8plex for testing and a user's manual. If you have any question about IQuant, please contact me: wenbo@genomics.cn. The source code of IQuant can be found here "https://sourceforge.net/p/iquant/code/".
    Downloads: 0 This Week
    Last Update:
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