DPDsim

23/06/16

Dissipative particle dynamics simulation of non-bonded particles. Based on [http://dx.doi.org/10.1063/1.474784](Groot, JCP, 1997).

Written in Fortran (pure or via f2py), Python, and Julia. Fortran is about an order of magnitude faster than Python/Numba.

Requirements

• Python3
• numpy, numba, docopt

TO DO

• [L] Add Verlet/neighbour list (as option)
• [L] Add bonds
• [M] Add pressure
• [S] Generalise velocity-Verlet algo