Calculating NOESY intensities from X-ray crystal structure

i like this post (click again to cancel)

i dont like this post (click again to cancel)

remove favorite mark from this question (click again to restore mark)

Hi folks,

Has anyone calculated NOESY intensities from a X-ray crystal structure? CORMA program calculates. But have anyone had any experience with XPlor-NIH or any other program? I've learnt RELAX, BKCALC etc., calculates. I want to calculate NOESY cross-peak intensities from the crystal structure for ay specified mixing time.

Any insight and help would be much appreciated!

Thanks, spinhalf

noesy

asked May 10 '13 at 11:39

nmrspin
1

Here (once you log in) you will be able to sign up for the periodic email updates about this question.

Be the first one to answer this question!

Please start posting your answer anonymously - your answer will be saved within the current session and published after you log in or create a new account. Please try to give a good answer, for discussions, please use comments and please do remember to vote (login to vote)

toggle preview

Tags:

noesy ×26

Asked: May 10 '13 at 11:39

Seen: 1,880 times

Last updated: May 10 '13 at 11:39

Related questions