Hi, Looking at the code for gen3d the force field seems to be hard coded so you would have to go to obgen.
Kind regards, Fredrik 8 maj 2014 kl. 10:26 skrev alchemist <alchemist...@abv.bg>: > I am using openbabel 2.3.1 under 64-bit windows 7. > As far as I understood from an old topic > <http://forums.openbabel.org/what-does-gen3d-do-under-the-hood-td3397296.html> > > --gen3d use MMFF94 force field. Am I correct? If so, I was just wondering is > it possible to change the forcefield or I have to use obgen application > instead? > > > > -- > View this message in context: > http://forums.openbabel.org/Is-it-possible-to-change-forcefield-when-using-gen3d-tp4657409.html > Sent from the General discussion mailing list archive at Nabble.com. > > ------------------------------------------------------------------------------ > Is your legacy SCM system holding you back? Join Perforce May 7 to find out: > • 3 signs your SCM is hindering your productivity > • Requirements for releasing software faster > • Expert tips and advice for migrating your SCM now > http://p.sf.net/sfu/perforce > _______________________________________________ > OpenBabel-discuss mailing list > OpenBabel-discuss@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
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