1 (858)784-2860
> email: fo...@scripps.edu
> http://www.scripps.edu/~forli/
> ________
> From: Stefano Guglielmo [stefano.guglie...@unito.it]
> Sent: Monday, January 04, 2016 4:12 PM
> To: openbabel-discuss@lists.sourceforge.net
> Subjec
cripps.edu/~forli/
From: Stefano Guglielmo [stefano.guglie...@unito.it]
Sent: Monday, January 04, 2016 4:12 PM
To: openbabel-discuss@lists.sourceforge.net
Subject: [Open Babel] azoxy
Dear opnebabel users,
I've made docking with autodock of some molecule
Dear opnebabel users,
I've made docking with autodock of some molecules containing an azoxy
function; I need to generate sdf file from pdbqt, but openbabel seems to
manage the molecules not so well as it adds hydrogens to the azoxy group.
Any suggestion about generating a correct sdf file?
Thanks
