Showing 3 open source projects for "dat"

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    LMAPper - The SPM and Mol Viewer

    LMAPper - The SPM and Mol Viewer

    Where SPM images and molecular models meet

    This application lets STM or AFM images AND molecular models to be overlaid. It is useful to understand how your molecules fit to what you observed and can help interpret your data. What makes this application more useful than paint programs (powerpoint or inkscape) is the fact that the size of the images and of the molecule is fixed, so that you know that you are working in real space. Check https://sourceforge.net/p/spm-and-mol-viewer/wiki/Home/ for updates.
    Downloads: 1 This Week
    Last Update:
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  • 2
    Cartes

    Cartes

    For all kinds of geometry transformations of molecules and crystals

    功能: A. 晶体坐标变换 -分数坐标和直角坐标互转 -向a,b,c三个方向堆积i,j,k个晶胞 -按给定对称关系得出所有相关原子 -按空间群对称性由不等价原子推出晶胞内所有原子 -查看空间群信息及对称等价位置 -自动转换*.cif文件 B. 分子坐标变换 -按指定对称操作任意平移、旋转、反映或反演当前的坐标 - 将一组坐标的中心平移到原点 -自动点群识别 -自动调整分子取向,包括 1)自动将分子的主轴调整到x,y,z轴上 2)自动将分子的自定义的某个轴调整到自定义的另外一个轴上 C. 各种文件格式的转换 注:Windows Vista使用注意:将cartes.exe的兼容模式改成Windows XP,并从用“管理员运行模式”
    Downloads: 0 This Week
    Last Update:
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  • 3
    xylib is a portable library for reading x-y data from powder diffraction, spectroscopy and other experimental methods. Supported formats: VAMAS, pdCIF, Bruker, Philips, Rigaku DAT, Sietronics CPI, DBWS/DMPLOT, Koalariet XDD and others.
    Downloads: 4 This Week
    Last Update:
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