CCL: Smiles -> 2D & 3D
- From: Lothar Terfloth <lothar.terfloth~!~mol-net.com>
- Subject: CCL: Smiles -> 2D & 3D
- Date: Tue, 18 Sep 2007 14:14:21 +0200
Sent to CCL by: Lothar Terfloth [lothar.terfloth|-|mol-net.com]
Dear all,
concerning the conversion of SMILES into 2D and 3D coordinates
I would like to direct your attention to Molecular Networks
solutions for these tasks:
2DCOOR
and
CORINA
You can find more information about 2D and 3D coordinate
generation below the following URLs:
http://www.mol-net.com/software/category/gen2dcoord.html
http://www.mol-net.com/software/category/gen3dcoord.html
Online demos are available at the URLs:
http://www.mol-net.com/online_demos/2dcoor_demo.html
and
http://www.mol-net.com/online_demos/corina_demo.html
Evaluation versions are available from our download
area: http://www.mol-net.com/php/profile.php
With kind regards,
Lothar Terfloth
--------------------------------------------------------
Dr. Lothar Terfloth Tel. +49-9131-9790623
Molecular Networks GmbH Fax: +49-9131-815 669
Henkestr. 91
D-91052 Erlangen
Germany
email: Lothar.Terfloth : mol-net.com
www: http://www.mol-net.com
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Ivanciuc, Ovidiu I. oiivanci _ utmb.edu wrote:
Sent to CCL by: "Ivanciuc, Ovidiu I." [oiivanci++utmb.edu]
for SMILES -> 2D: GIF/PNG-Creator
http://cactus.nci.nih.gov/services/gifcreator/
for SMILES -> 2D &3D: SDF, PDB, MOL
http://cactus.nci.nih.gov/services/translate/
O.
--
--------------------------------------------------------
Dr. Lothar Terfloth Tel. +49-9131-9790623
Molecular Networks GmbH Fax: +49-9131-815 669
Henkestr. 91
D-91052 Erlangen
Germany
email: Lothar.Terfloth : mol-net.com
www: http://www.mol-net.com
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