Ben Webb wrote:
I added the wrappers since I got bitten by the thisown part not being there. Better to have untested working code than untested nonworking code :-)Daniel Russel wrote:Why did you skip the MonteCarlo and NonbondedList parts?The added methods are not used or tested in the Python code, and would not really be usable anyway since the relevant std::vectors are not instantiated in the SWIG wrapper. I can certainly add these in if you have a use for them though.