SPINEVOLUTION is, from its web site, a highly efficient computer program for the numerical simulation of NMR experiments and spin dynamics in general.
Its installation on Flux has some more nuances than other software, but Flux is a general platform and SPINEVOLUTION can be installed and run on Flux.
The LSA Research Support and Advocacy group, and Mark Montague in particular, have documented in installation and use of SPINEVOLUTION on Flux at https://sites.google.com/a/umich.edu/flux-support/software/lsa/spinevolution
While SPINEVOLUTION is a narrowly focused software package, the details of its installation on Flux may be applicable to other narrowly focused software packages.
For more information, please send email to firstname.lastname@example.org.