VMD-L Mailing List
From: Axel Kohlmeyer (akohlmey_at_gmail.com)
Date: Tue Apr 29 2014 - 08:54:50 CDT
On Tue, Apr 29, 2014 at 8:49 AM, Jean-Patrick Francoia
> I wonder if there is a way to visualize a SMILES string in VMD, and possibly
> in 3D. I did a bit of digging but found nothing clear.
> How do you do that ?
find a program/tool that converts a SMILES string into a supported
file format and then load that file into VMD.
-- Dr. Axel Kohlmeyer akohlmey_at_gmail.com http://goo.gl/1wk0 College of Science & Technology, Temple University, Philadelphia PA, USA International Centre for Theoretical Physics, Trieste. Italy.