convert SDF format to MM3

Previous Topic Next Topic
 
classic Classic list List threaded Threaded
2 messages Options
Reply | Threaded
Open this post in threaded view
|

convert SDF format to MM3

Moshe Ben-zion

I cannot find the MM3 format as an output option. Is there a way to access it or perhaps an equivalent (identical) format under another name?

 

Dr. Moshe Ben-Tzion

Department of Chemistry

Bar-Ilan University, Ramat Gan 52900, Israel

e-mail: [hidden email]

Website: http://ch.biu.ac.il/bentzion

Tel: (03) 531-8305   Fax: 972-3-738-4053

Cell:(054) 660-3310   Beeper: 88341(610-6666)

=============================================

In the beginning there was nothing and then G-d created light.

And there was still nothing but you could see it better.

 


------------------------------------------------------------------------------
Site24x7 APM Insight: Get Deep Visibility into Application Performance
APM + Mobile APM + RUM: Monitor 3 App instances at just $35/Month
Monitor end-to-end web transactions and take corrective actions now
Troubleshoot faster and improve end-user experience. Signup Now!
http://pubads.g.doubleclick.net/gampad/clk?id=267308311&iu=/4140
_______________________________________________
OpenBabel-discuss mailing list
[hidden email]
https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
Reply | Threaded
Open this post in threaded view
|

Re: convert SDF format to MM3

Geoff Hutchison
> I cannot find the MM3 format as an output option. Is there a way to access it or perhaps an equivalent (identical) format under another name?


The Tinker format assigns MM3 atom types. If this doesn’t match the MM3 file format, it’s probably pretty similar.

-Geoff
------------------------------------------------------------------------------
Site24x7 APM Insight: Get Deep Visibility into Application Performance
APM + Mobile APM + RUM: Monitor 3 App instances at just $35/Month
Monitor end-to-end web transactions and take corrective actions now
Troubleshoot faster and improve end-user experience. Signup Now!
http://pubads.g.doubleclick.net/gampad/clk?id=272487151&iu=/4140
_______________________________________________
OpenBabel-discuss mailing list
[hidden email]
https://lists.sourceforge.net/lists/listinfo/openbabel-discuss