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HuckelCode

Files related to the Bachelor thesis project.

A software toolkit created in C++ based on the yaehmop application.

The project comprised of the following:

  1. Making the yaehmop project C++ compatible.
  2. Creating a valid protein input parser for yaehmop.
  3. Comparing Lapack and Blas versions, adding OpenBlas to yaehmop.
  4. Creating a sparse matrix output module (Matrix Market format).