Re: [ccp4bb] directly write .mol or .sdf files

2007-04-24 Thread Dante Neculai
I think openbabel (http://openbabel.sourceforge.net/wiki/Main_Page) might do it! Dante Neculai -Original Message- From: CCP4 bulletin board on behalf of Ingo P. Korndoerfer Sent: Tue 4/24/2007 5:10 PM To: CCP4BB@JISCMAIL.AC.UK Subject: [ccp4bb] directly write .mol or .sdf files dear

[ccp4bb] directly write .mol or .sdf files

2007-04-24 Thread Ingo P. Korndoerfer
dear colleagues, after working around the topic for a while now or avoiding it alltogether, it has now become time to ask: could some friendly soul point me to a program that would create a .mol or .sdf file from 1. a refmac dictionary file (to yield a .mol file randomly positioned and oriented)