Open openbabel-bot opened 9 years ago
Update: I got --confab to work after all. It appears that the input file was to blame for it not working (0 rotatable bonds)
--conf is the correct way to specify number of conformers, not -nconfs
So (2) and (3) properly work with obabel --confab.
Original comment by: benalbrecht
I have 3 installations of Open Babel I am testing with:
(1) Installed on Mac OS X 10.10.1, using v2.3.1 installer from downloads page (2) Installed on Mac OS X 10.10.1, building from git repository, v2.3.90 (3) Installed on Ubuntu 14.04, building from git repository, v2.3.90
First, there is some ambiguity in the documentation for confab for number of conformers:
In options list: --conf used