g-BAOAB source files



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)

Data Citation

Matthews, Charles. (2016). g-BAOAB source files, 2014-2016 [dataset]. University of Edinburgh, School of Mathematics. http://dx.doi.org/10.7488/ds/1365.
Date made available5 Apr 2016
PublisherEdinburgh DataShare

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