CCL: Free Tool for conformer generation
- From: "Raphael A. Bauer"
<raphael.bauer**charite.de>
- Subject: CCL: Free Tool for conformer generation
- Date: Mon, 05 Mar 2007 17:31:27 +0100
Sent to CCL by: "Raphael A. Bauer" [raphael.bauer,charite.de]
Hi CC List,
I am wondering if anybody of you knows a tool for the generation of
conformers. Pretty much what Catalyst does. But - for my project I
would
need something "free" (open source) and scriptable (command
line version
maybe).
Any recommendations for good tools?
Many thanks in advance!
Raphael