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  • jdurrant / pyrite

    GNU General Public License v3.0 only

    A Blender plugin for importing a molecular dynamics trajectory, to take advantage of Blender's advanced rendering features.

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  • jdurrant / scoria

    Apache License 2.0

    Scoria is a Python package for manipulating 3D molecular data.

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    Updated
  • jdurrant / liggrep

    Apache License 2.0

    LigGrep is a program for identifying docked poses that participate in user-specified receptor/ligand interactions. It evaluates each docked pose and outputs the names of the compounds with poses that pass all filters.

    Updated
    Updated