NMR structure determination software



Greetings CCL’ers:

 

I was wondering if any of you were willing to share your expert opinion on the type of minimal and hopefully rather inexpensive software set-up needed to solve NMR solution structures (including visualization). I’m currently using MOE which I really like for all my modeling needs but it really has too many bells and whistles for just the NMR structure determination that we want to accomplish now.

 

I do understand that there exist many algorithms to solve NMR structures – many of which are “free” to non-profit organizations - and I do not want to embark on a discussion of how and which software is better. I simple want to see if there is a "at@at" simple "at@at" cost-effective NMR structure determination set-up for commercial organizations.

 

If any of you offer such solutions, please do not hesitate to contact me as I am interested.

Again many thanks to the community for the immense help,

 

APM