#22 added an extensive set of host-guest input files for the host-guest sets from the paper, courtesy of Jian Yin from the Gilson lab. I need to adjust the README she kindly provided into a README.md, and add a manifest of what files were added and how they were organized.
#22 added an extensive set of host-guest input files for the host-guest sets from the paper, courtesy of Jian Yin from the Gilson lab. I need to adjust the README she kindly provided into a README.md, and add a manifest of what files were added and how they were organized.