- CLI parameters
--cx,--cy,--cz,--rx,--ry, and--rzcan now be floats (not just integers). We recommend specifying the exact atomic coordinates of the connection and removal points. - Fixed a bug that caused the
--fullparameter to throw an error when performing fragment addition (but not fragment replacement) using the CLI implementation. - Minor updates to the documentation.
- Added a CLI implementation of the program. See
README.mdfor details. - Added a version number and citation to the program output.
- Removed open-babel dependency.
- Added option (
cpu_gridify) to improve use on CPUs when no GPU is available. - Updated
data/README.mdwith new location of data files. - Fixed a config import.
Original version.