Re: [Open Babel] ANNOUNCE: Open Babel 2.4.0 Released

2016-09-26 Thread Giovanni Cincilla
That's great Geoff! Thank you for the info and congrats again for the new OB version! Gio -- View this message in context: http://forums.openbabel.org/ANNOUNCE-Open-Babel-2-4-0-Released-tp4659490p4659505.html Sent from the General discussion mailing list archive at Nabble.com.

Re: [Open Babel] ANNOUNCE: Open Babel 2.4.0 Released

2016-09-26 Thread Geoffrey Hutchison
Ooh, sorry - I see it didn’t get into the docs. :-( You can just say: .. --gen3d fastest The levels are: fastest fast med or medium slow or better slowest or best The different levels correspond to different # of conformers and optimization steps. For example fastest will skip conformer genera

Re: [Open Babel] ANNOUNCE: Open Babel 2.4.0 Released

2016-09-24 Thread Giovanni Cincilla
Wonderful news! It seems a big step forward. Congrats to you all guys! I would have a question about it. In the SourceForge page one of the reported new feature/improvment is: '3D generation: "--gen3d", allow user to specify the desired speed/quality' I would be interested in exploring such a pos

[Open Babel] ANNOUNCE: Open Babel 2.4.0 Released

2016-09-22 Thread Geoffrey Hutchison
I'm pleased to announce that Open Babel 2.4.0 has finally been released. This release represents a major update and should be a stable upgrade, strongly recommended for all users. We intend to move to an annual major release every September, with bug fix releases as needed. A sample of major n