This analysis of NBO results from Gaussian shows the underlying molecular interactions, highlighting computational methods.
I’m posting this white paper “as is” but I will keep on coming back to update it; the thing is that I haven’t had the time to post anything else lately and if I don’t do it like this then I will never get it out. Please be kind on your comments and ratings! For a more thorough discussion of NBO analysis please check out the references.
No takes yet. Share an insight, caveat, or question.
Joaquin Barroso (2009) studied this question.
Synapse has enriched 5 closely related papers on similar clinical questions. Consider them for comparative context: