pdb

Package to handle GROMACS topology stuff

The aim of this project is to build a Ramachandran diagram from PDB files. PDB files, three-dimensional structure files representing protein protein skeletons, in order to create a Ramachandran diagram. The Ramachandran diagram is used to define protein conformation (Alpha helix or Beta leaflet) via two angles (phi and psi) which are calculated from the amino acids in the PDB file.

learn the Test Driven Development methods, from this blog https://code.tutsplus.com/tutorials/beginning-test-driven-development-in-python--net-30137