Re: [Jmol-users] problem when selecting smarts [#6]-[#6]

[Robert H. <ha...@st...>]

Terrific. Somehow I never found that myself. We should test a few other
aspects as well. I should note that Jmol will have a different definition of
"aromatic" -- not one based on bonding. Essentially our definition is
"aromatic or antiaromatic" -- ring, all sp2, that's all. That's possible
because we are starting with actual 3D structures generally, not just SMILES
strings.

Bob

-- 
Robert M. Hanson
Professor of Chemistry
St. Olaf College
1520 St. Olaf Ave.
Northfield, MN 55057
http://www.stolaf.edu/people/hansonr
phone: 507-786-3107


If nature does not answer first what we want,
it is better to take what answer we get.

-- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900