Matthews, Charles. (2016). g-BAOAB source files, 2014-2016 [dataset]. University of Edinburgh. School of Mathematics. http://dx.doi.org/10.7488/ds/1365.
The files included here are the code files needed to implement the geodesic integration schemes relevant to the manuscript: "Efficient molecular dynamics using geodesic integration and solvent-solute splitting" (Proceedings of the Royal Society, 2016).