At present there are no CCP6 flagship research projects.
The project which has just finished was dedicated to multi-dimensional time-dependent
wavepacket calculations. It was aimed at expanding the capabilities of Heidelberg MCTDH code.
The project was lead by Dr. Graham A. Worth. The target application was a study of H2O
scattering off the surface of a protein.
Other codes developed under earlier flagship projects include the time-independent
reactive scattering program ABC (now one of the most successful codes in the world
at interpreting data from atom-diatom reactive scattering experiments), the inelastic
scattering package MOLSCAT, the interactive non-linear fitting package
I-NoLLS, and other codes such as BOUND, EDW-VCC-IOS,DVR3D and
WAVR4, all of which can be downloaded from our software