Notes from Damian about these files Down to the simplest systems for tests and any necessary reparameterizations. All of these systems are composed of single bonds between two atoms and all other valences filled with Hydrogen. The labeling scheme is FragmentA_FragmentB.mmp/pdb with the two important atoms connected by the "_". In some cases, like H_X, the parameter is for the H-X bond. Also notices a little import issue with the CAD side (it won't read H2 as a connected system). I'll bring that one up. The double bond systems are mostly done. There are a few problem structures that nature never intended that, despite my wish to have the exhaustive set, we maybe should intend either. I'd hate to be the guy proposing the structure at a board meeting arguing that the existence of parameters means we've got a shot of making it.