Welcome to the documentation for Fast Forward

Fast forward is a simple and fast tool for forward mapping trajectories and computing interactions. Atomistic trajectories can be forward mapped from mapping files that correspond to backwards mapping style format. Interactions are computed from itp files automatically creating the time-series and distribution. Note that we use the numba library for parallel acceleration.

Installation

git clone https://github.com/fgrunewald/fast_forward.git
cd fast_forward
pip install ./

Tutorials

API Reference