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  1. MANULS MANULS Public

    A program for the electrostatic catalysis of chemical rections. MANULS finds the smallest electric field that removes the reaction barrier.

    Python 8 1

  2. Rendering-suggestions Rendering-suggestions Public

    Some things that I find useful when preparing images with VMD

    Tcl 1

  3. how-to-align-molecule-to-axes how-to-align-molecule-to-axes Public

    A procedure to align a molecule along a cartesian axis