This interface offers a partial implementation of the Universal Force Field (UFF)[1], making it possible to carry out simplie calculations in Cuby without any external software. It is useful for testing and demonstration purposes.

The implementation has following limitations:

  1. J. Am. Chem. Soc. 114(25), 10024, 1992
  2. J. Phys. Chem. A, 2002, 106 (34), pp 7887–7894